N-[2-[3-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[3-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[3-[2-(4-butylanilino)-2-oxo-ethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide CAS Name: N-[2-[3-[[2-(4-butylanilino)-2-oxoethyl]thio]-1-indolyl]ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[3-[2-(4-butylanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide Traditional Name: N-[2-[3-[[2-(4-butylanilino)-2-keto-ethyl]thio]indol-1-yl]ethyl]thiophene-2-carboxamide Formula: C27H29N3O2S2 MolecularWeight: 491.66806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC=CS4

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC=CS4

InChI

InChI=1S/C27H29N3O2S2/c1-2-3-7-20-11-13-21(14-12-20)29-26(31)19-34-25-18-30(23-9-5-4-8-22(23)25)16-15-28-27(32)24-10-6-17-33-24/h4-6,8-14,17-18H,2-3,7,15-16,19H2,1H3,(H,28,32)(H,29,31)