3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[5-(diethylamino)pentan-2-yl]benzamide hydrochloride

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[5-(diethylamino)pentan-2-yl]benzamide hydrochloride Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[4-(diethylamino)-1-methyl-butyl]benzamide hydrochloride CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[5-(diethylamino)pentan-2-yl]benzamide hydrochloride IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[5-(diethylamino)pentan-2-yl]benzamide hydrochloride Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[4-(diethylamino)-1-methyl-butyl]benzamide hydrochloride Formula: C22H37Cl2N3O3S MolecularWeight: 494.51848

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2.Cl

Isomeric SMILES

CCN(CC)CCCC(C)NC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2.Cl

InChI

InChI=1S/C22H36ClN3O3S.ClH/c1-4-25(5-2)14-10-11-18(3)24-22(27)19-12-13-20(23)21(17-19)30(28,29)26-15-8-6-7-9-16-26;/h12-13,17-18H,4-11,14-16H2,1-3H3,(H,24,27);1H