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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(3-morpholin-4-ylpropyl)benzamide hydrochloride Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(3-morpholinopropyl)benzamide hydrochloride CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[3-(4-morpholinyl)propyl]benzamide hydrochloride IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(3-morpholin-4-ylpropyl)benzamide hydrochloride Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(3-morpholinopropyl)benzamide hydrochloride Formula: C20H31Cl2N3O4S MolecularWeight: 480.44884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCCN3CCOCC3)Cl.Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCCN3CCOCC3)Cl.Cl

InChI

InChI=1S/C20H30ClN3O4S.ClH/c21-18-7-6-17(20(25)22-8-5-9-23-12-14-28-15-13-23)16-19(18)29(26,27)24-10-3-1-2-4-11-24;/h6-7,16H,1-5,8-15H2,(H,22,25);1H