1-butyl-5-oxidanylidene-N-[4-[(2-phenylsulfanylphenyl)carbamoyl]phenyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-butyl-5-oxidanylidene-N-[4-[(2-phenylsulfanylphenyl)carbamoyl]phenyl]pyrrolidine-3-carboxamide Openeye Name: 1-butyl-5-oxo-N-[4-[(2-phenylsulfanylphenyl)carbamoyl]phenyl]pyrrolidine-3-carboxamide CAS Name: 1-butyl-5-oxo-N-[4-[oxo-[2-(phenylthio)anilino]methyl]phenyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-butyl-5-oxo-N-[4-[(2-phenylsulfanylphenyl)carbamoyl]phenyl]pyrrolidine-3-carboxamide Traditional Name: 1-butyl-5-keto-N-[4-[[2-(phenylthio)phenyl]carbamoyl]phenyl]pyrrolidine-3-carboxamide Formula: C28H29N3O3S MolecularWeight: 487.61316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4

Isomeric SMILES

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4

InChI

InChI=1S/C28H29N3O3S/c1-2-3-17-31-19-21(18-26(31)32)28(34)29-22-15-13-20(14-16-22)27(33)30-24-11-7-8-12-25(24)35-23-9-5-4-6-10-23/h4-16,21H,2-3,17-19H2,1H3,(H,29,34)(H,30,33)