4-[(4Z)-4-indol-3-ylidene-3-[[(2-methoxyphenyl)amino]methyl]-3,5-dihydro-2H-1,5-benzothiazepin-2-yl]-2-methoxy-phenol

Systemtic Name: 4-[(4Z)-4-indol-3-ylidene-3-[[(2-methoxyphenyl)amino]methyl]-3,5-dihydro-2H-1,5-benzothiazepin-2-yl]-2-methoxy-phenol Openeye Name: 4-[(4Z)-4-indol-3-ylidene-3-[(2-methoxyanilino)methyl]-3,5-dihydro-2H-1,5-benzothiazepin-2-yl]-2-methoxy-phenol CAS Name: 4-[(4Z)-4-(3-indolylidene)-3-[(2-methoxyanilino)methyl]-3,5-dihydro-2H-1,5-benzothiazepin-2-yl]-2-methoxyphenol IUPAC Name: 4-[(4Z)-4-indol-3-ylidene-3-[(2-methoxyanilino)methyl]-3,5-dihydro-2H-1,5-benzothiazepin-2-yl]-2-methoxyphenol Traditional Name: 4-[(4Z)-4-indol-3-ylidene-3-(o-anisidinomethyl)-3,5-dihydro-2H-1,5-benzothiazepin-2-yl]-2-methoxy-phenol Formula: C32H29N3O3S MolecularWeight: 535.65596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NCC2C(SC3=CC=CC=C3NC2=C4C=NC5=CC=CC=C54)C6=CC(=C(C=C6)O)OC

Isomeric SMILES

COC1=CC=CC=C1NCC\2C(SC3=CC=CC=C3N/C2=C/4\C=NC5=CC=CC=C54)C6=CC(=C(C=C6)O)OC

InChI

InChI=1S/C32H29N3O3S/c1-37-28-13-7-5-11-25(28)34-19-23-31(22-18-33-24-10-4-3-9-21(22)24)35-26-12-6-8-14-30(26)39-32(23)20-15-16-27(36)29(17-20)38-2/h3-18,23,32,34-36H,19H2,1-2H3/b31-22+