N-[4-(azepan-1-ylsulfonyl)phenyl]-1-[2-(4-fluorophenyl)ethyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-1-[2-(4-fluorophenyl)ethyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-1-[2-(4-fluorophenyl)ethyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-1-[2-(4-fluorophenyl)ethyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-1-[2-(4-fluorophenyl)ethyl]-5-keto-pyrrolidine-3-carboxamide Formula: C25H30FN3O4S MolecularWeight: 487.586803

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CC(=O)N(C3)CCC4=CC=C(C=C4)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CC(=O)N(C3)CCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H30FN3O4S/c26-21-7-5-19(6-8-21)13-16-28-18-20(17-24(28)30)25(31)27-22-9-11-23(12-10-22)34(32,33)29-14-3-1-2-4-15-29/h5-12,20H,1-4,13-18H2,(H,27,31)