3-(azepan-1-ylsulfonyl)-4-chloranyl-N-phenethyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-phenethyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-phenethyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-phenethylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-phenethylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-phenethyl-benzamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCC3=CC=CC=C3)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H25ClN2O3S/c22-19-11-10-18(21(25)23-13-12-17-8-4-3-5-9-17)16-20(19)28(26,27)24-14-6-1-2-7-15-24/h3-5,8-11,16H,1-2,6-7,12-15H2,(H,23,25)