3-(azepan-1-ylsulfonyl)-4-chloranyl-N-cyclopropyl-N-(thiophen-2-ylmethyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-cyclopropyl-N-(thiophen-2-ylmethyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-cyclopropyl-N-(2-thienylmethyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-cyclopropyl-N-(thiophen-2-ylmethyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-cyclopropyl-N-(thiophen-2-ylmethyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-cyclopropyl-N-(2-thenyl)benzamide Formula: C21H25ClN2O3S2 MolecularWeight: 453.0178

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N(CC3=CC=CS3)C4CC4)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N(CC3=CC=CS3)C4CC4)Cl

InChI

InChI=1S/C21H25ClN2O3S2/c22-19-10-7-16(14-20(19)29(26,27)23-11-3-1-2-4-12-23)21(25)24(17-8-9-17)15-18-6-5-13-28-18/h5-7,10,13-14,17H,1-4,8-9,11-12,15H2