3-(azepan-1-ylsulfonyl)-N-(4-pyrrolidin-1-ylphenyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(4-pyrrolidin-1-ylphenyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(4-pyrrolidin-1-ylphenyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[4-(1-pyrrolidinyl)phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(4-pyrrolidin-1-ylphenyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(4-pyrrolidinophenyl)benzamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)N4CCCC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)N4CCCC4

InChI

InChI=1S/C23H29N3O3S/c27-23(24-20-10-12-21(13-11-20)25-14-5-6-15-25)19-8-7-9-22(18-19)30(28,29)26-16-3-1-2-4-17-26/h7-13,18H,1-6,14-17H2,(H,24,27)