ZINC07266958
Molecular Formula:
C
20
H
27
N
2
O
3
S
+
InChI:
InChI=1/C20H26N2O3S/c1-12-17(20(24)25-5)13(2)21-18(12)19(23)14(3)22(4)11-15-7-9-16(26-6)10-8-15/h7-10,14,21H,11H2,1-6H3/p+1/t14-/m0/s1/fC20H27N2O3S/h22H/q+1
InChIKey:
InChIKey=KSWTVQGDDSKCQZ-IZUMAEOZDT
SMILES:
CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)[NH+](C)CC2=CC=C(C=C2)SC
Names:
ZINC07266958
[(2S)-1-(4-methoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxo-propan-2-yl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium
Registries:
PubChem CID 8365889
PubChem ID 13680863