4-[(Z)-[3-ethoxycarbonyl-4-methyl-9-oxo-2-(4-propan-2-ylphenyl)-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-dien-8-ylidene]methyl]benzoic acid
Molecular Formula:
C
27
H
26
N
2
O
5
S
InChI:
InChI=1/C27H26N2O5S/c1-5-34-26(33)22-16(4)28-27-29(23(22)19-12-10-18(11-13-19)15(2)3)24(30)21(35-27)14-17-6-8-20(9-7-17)25(31)32/h6-15,23H,5H2,1-4H3,(H,31,32)/b21-14-/f/h31H
InChIKey:
InChIKey=OTMULPYJGARLGK-BRTPYNRDDT
SMILES:
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(C)C)C(=O)C(=CC4=CC=C(C=C4)C(=O)O)S2)C
Names:
4-[(Z)-[3-ethoxycarbonyl-4-methyl-9-oxo-2-(4-propan-2-ylphenyl)-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-dien-8-ylidene]methyl]benzoic acid
Registries:
PubChem CID 6296290
PubChem ID 11592332