N-[2-[3-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-4-ethoxy-benzamide

Systemtic Name: N-[2-[3-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-4-ethoxy-benzamide Openeye Name: N-[2-[3-[2-(4-bromoanilino)-2-oxo-ethyl]sulfanylindol-1-yl]ethyl]-4-ethoxy-benzamide CAS Name: N-[2-[3-[[2-(4-bromoanilino)-2-oxoethyl]thio]-1-indolyl]ethyl]-4-ethoxybenzamide IUPAC Name: N-[2-[3-[2-(4-bromoanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-ethoxybenzamide Traditional Name: N-[2-[3-[[2-(4-bromoanilino)-2-keto-ethyl]thio]indol-1-yl]ethyl]-4-ethoxy-benzamide Formula: C27H26BrN3O3S MolecularWeight: 552.48264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C27H26BrN3O3S/c1-2-34-22-13-7-19(8-14-22)27(33)29-15-16-31-17-25(23-5-3-4-6-24(23)31)35-18-26(32)30-21-11-9-20(28)10-12-21/h3-14,17H,2,15-16,18H2,1H3,(H,29,33)(H,30,32)