N-[3-[tert-butylcarbamoyl-(3-methoxyphenyl)amino]-5-(4-fluorophenyl)-2-oxidanylidene-7-phenyl-azepan-1-yl]ethanamide

Systemtic Name: N-[3-[tert-butylcarbamoyl-(3-methoxyphenyl)amino]-5-(4-fluorophenyl)-2-oxidanylidene-7-phenyl-azepan-1-yl]ethanamide Openeye Name: N-[3-[N-(tert-butylcarbamoyl)-3-methoxy-anilino]-5-(4-fluorophenyl)-2-oxo-7-phenyl-azepan-1-yl]acetamide CAS Name: N-[3-(N-[(tert-butylamino)-oxomethyl]-3-methoxyanilino)-5-(4-fluorophenyl)-2-oxo-7-phenyl-1-azepanyl]acetamide IUPAC Name: N-[3-[N-(tert-butylcarbamoyl)-3-methoxyanilino]-5-(4-fluorophenyl)-2-oxo-7-phenylazepan-1-yl]acetamide Traditional Name: N-[3-[N-(tert-butylcarbamoyl)-3-methoxy-anilino]-5-(4-fluorophenyl)-2-keto-7-phenyl-azepan-1-yl]acetamide Formula: C32H37FN4O4 MolecularWeight: 560.658983

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NN1C(CC(CC(C1=O)N(C2=CC(=CC=C2)OC)C(=O)NC(C)(C)C)C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NN1C(CC(CC(C1=O)N(C2=CC(=CC=C2)OC)C(=O)NC(C)(C)C)C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C32H37FN4O4/c1-21(38)35-37-28(23-10-7-6-8-11-23)18-24(22-14-16-25(33)17-15-22)19-29(30(37)39)36(31(40)34-32(2,3)4)26-12-9-13-27(20-26)41-5/h6-17,20,24,28-29H,18-19H2,1-5H3,(H,34,40)(H,35,38)