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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(3-imidazol-1-ylpropyl)benzamide hydrochloride Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(3-imidazol-1-ylpropyl)benzamide hydrochloride CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[3-(1-imidazolyl)propyl]benzamide hydrochloride IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(3-imidazol-1-ylpropyl)benzamide hydrochloride Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(3-imidazol-1-ylpropyl)benzamide hydrochloride Formula: C19H26Cl2N4O3S MolecularWeight: 461.40574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25ClN4O3S.ClH/c20-17-7-6-16(19(25)22-8-5-10-23-13-9-21-15-23)14-18(17)28(26,27)24-11-3-1-2-4-12-24;/h6-7,9,13-15H,1-5,8,10-12H2,(H,22,25);1H