phenylsulfanylmethyl (5Z)-6-oxidanylidene-5-[[2-[[(Z)-[6-oxidanylidene-5-(phenylsulfanylmethoxycarbonyl)cyclohexa-2,4-dien-1-ylidene]methyl]amino]ethylamino]methylidene]cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: phenylsulfanylmethyl (5Z)-6-oxidanylidene-5-[[2-[[(Z)-[6-oxidanylidene-5-(phenylsulfanylmethoxycarbonyl)cyclohexa-2,4-dien-1-ylidene]methyl]amino]ethylamino]methylidene]cyclohexa-1,3-diene-1-carboxylate Openeye Name: phenylsulfanylmethyl (5Z)-6-oxo-5-[[2-[[(Z)-[6-oxo-5-(phenylsulfanylmethoxycarbonyl)cyclohexa-2,4-dien-1-ylidene]methyl]amino]ethylamino]methylene]cyclohexa-1,3-diene-1-carboxylate CAS Name: (5Z)-6-oxo-5-[[2-[[(Z)-[6-oxo-5-[oxo-[(phenylthio)methoxy]methyl]-1-cyclohexa-2,4-dienylidene]methyl]amino]ethylamino]methylidene]-1-cyclohexa-1,3-dienecarboxylic acid (phenylthio)methyl ester IUPAC Name: phenylsulfanylmethyl (5Z)-6-oxo-5-[[2-[[(Z)-[6-oxo-5-(phenylsulfanylmethoxycarbonyl)cyclohexa-2,4-dien-1-ylidene]methyl]amino]ethylamino]methylidene]cyclohexa-1,3-diene-1-carboxylate Traditional Name: (5Z)-6-keto-5-[[2-[[(Z)-[6-keto-5-[(phenylthio)methoxycarbonyl]cyclohexa-2,4-dien-1-ylidene]methyl]amino]ethylamino]methylene]cyclohexa-1,3-diene-1-carboxylic acid (phenylthio)methyl ester Formula: C32H28N2O6S2 MolecularWeight: 600.70452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCOC(=O)C2=CC=CC(=CNCCNC=C3C=CC=C(C3=O)C(=O)OCSC4=CC=CC=C4)C2=O

Isomeric SMILES

C1=CC=C(C=C1)SCOC(=O)C2=CC=C/C(=C/NCCN/C=C/3\C(=O)C(=CC=C3)C(=O)OCSC4=CC=CC=C4)/C2=O

InChI

InChI=1S/C32H28N2O6S2/c35-29-23(9-7-15-27(29)31(37)39-21-41-25-11-3-1-4-12-25)19-33-17-18-34-20-24-10-8-16-28(30(24)36)32(38)40-22-42-26-13-5-2-6-14-26/h1-16,19-20,33-34H,17-18,21-22H2/b23-19-,24-20-