4-(azepan-1-ylsulfonyl)-N-(3-imidazol-1-ylpropyl)benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-(3-imidazol-1-ylpropyl)benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(3-imidazol-1-ylpropyl)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[3-(1-imidazolyl)propyl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(3-imidazol-1-ylpropyl)benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(3-imidazol-1-ylpropyl)benzamide Formula: C19H26N4O3S MolecularWeight: 390.49974

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCCN3C=CN=C3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C19H26N4O3S/c24-19(21-10-5-12-22-15-11-20-16-22)17-6-8-18(9-7-17)27(25,26)23-13-3-1-2-4-14-23/h6-9,11,15-16H,1-5,10,12-14H2,(H,21,24)