ethyl (E)-3-[[2-[(2-azanyl-5-phenoxy-phenyl)disulfanyl]-4-phenoxy-phenyl]amino]but-2-enoate

Systemtic Name: ethyl (E)-3-[[2-[(2-azanyl-5-phenoxy-phenyl)disulfanyl]-4-phenoxy-phenyl]amino]but-2-enoate Openeye Name: ethyl (E)-3-[2-[(2-amino-5-phenoxy-phenyl)disulfanyl]-4-phenoxy-anilino]but-2-enoate CAS Name: (E)-3-[2-[(2-amino-5-phenoxyphenyl)disulfanyl]-4-phenoxyanilino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[2-[(2-amino-5-phenoxyphenyl)disulfanyl]-4-phenoxyanilino]but-2-enoate Traditional Name: (E)-3-[2-[(2-amino-5-phenoxy-phenyl)disulfanyl]-4-phenoxy-anilino]but-2-enoic acid ethyl ester Formula: C30H28N2O4S2 MolecularWeight: 544.68432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NC1=C(C=C(C=C1)OC2=CC=CC=C2)SSC3=C(C=CC(=C3)OC4=CC=CC=C4)N

Isomeric SMILES

CCOC(=O)/C=C(\C)/NC1=C(C=C(C=C1)OC2=CC=CC=C2)SSC3=C(C=CC(=C3)OC4=CC=CC=C4)N

InChI

InChI=1S/C30H28N2O4S2/c1-3-34-30(33)18-21(2)32-27-17-15-25(36-23-12-8-5-9-13-23)20-29(27)38-37-28-19-24(14-16-26(28)31)35-22-10-6-4-7-11-22/h4-20,32H,3,31H2,1-2H3/b21-18+