N-[4-[[4-(azepan-1-ylsulfonyl)phenyl]carbamoyl]phenyl]-5-oxidanylidene-1-propan-2-yl-pyrrolidine-3-carboxamide

Systemtic Name: N-[4-[[4-(azepan-1-ylsulfonyl)phenyl]carbamoyl]phenyl]-5-oxidanylidene-1-propan-2-yl-pyrrolidine-3-carboxamide Openeye Name: N-[4-[[4-(azepan-1-ylsulfonyl)phenyl]carbamoyl]phenyl]-1-isopropyl-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[4-[[4-(1-azepanylsulfonyl)anilino]-oxomethyl]phenyl]-5-oxo-1-propan-2-yl-3-pyrrolidinecarboxamide IUPAC Name: N-[4-[[4-(azepan-1-ylsulfonyl)phenyl]carbamoyl]phenyl]-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide Traditional Name: N-[4-[[4-(azepan-1-ylsulfonyl)phenyl]carbamoyl]phenyl]-1-isopropyl-5-keto-pyrrolidine-3-carboxamide Formula: C27H34N4O5S MolecularWeight: 526.64766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC(C)N1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C27H34N4O5S/c1-19(2)31-18-21(17-25(31)32)27(34)29-22-9-7-20(8-10-22)26(33)28-23-11-13-24(14-12-23)37(35,36)30-15-5-3-4-6-16-30/h7-14,19,21H,3-6,15-18H2,1-2H3,(H,28,33)(H,29,34)