3-[[4-[4-(benzo[1,3]dioxol-5-ylmethyl)2,3,5,6-tetrahydropyrazine-1-carbonyl]cyclohexyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one
Molecular Formula:
C28H33N4O4S+
InChI: InChI=1/C28H32N4O4S/c33-26(31-13-11-30(12-14-31)16-20-7-10-24-25(15-20)36-18-35-24)21-8-5-19(6-9-21)17-32-27(34)22-3-1-2-4-23(22)29-28(32)37/h1-4,7,10,15,19,21H,5-6,8-9,11-14,16-18H2,(H,29,37)/p+1/fC28H33N4O4S/h29-30H/q+1
InChIKey: InChIKey=OBWIBAGDLKXXAA-MUHDIIAZCC
SMILES: C1CC(CCC1CN2C(=O)C3=CC=CC=C3NC2=S)C(=O)N4CC[NH+](CC4)CC5=CC6=C(C=C5)OCO6
Names:
3-[[4-[4-(benzo[1,3]dioxol-5-ylmethyl)2,3,5,6-tetrahydropyrazine-1-carbonyl]cyclohexyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one
Registries:
PubChem CID 4088288
PubChem ID 6006504
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