N-[6-[4-(4-chlorophenyl)sulfonyl-1,4-diazepan-1-yl]pyridin-3-yl]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[6-[4-(4-chlorophenyl)sulfonyl-1,4-diazepan-1-yl]pyridin-3-yl]-2-thiophen-2-yl-ethanamide Openeye Name: N-[6-[4-(4-chlorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-pyridyl]-2-(2-thienyl)acetamide CAS Name: N-[6-[4-(4-chlorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-pyridinyl]-2-thiophen-2-ylacetamide IUPAC Name: N-[6-[4-(4-chlorophenyl)sulfonyl-1,4-diazepan-1-yl]pyridin-3-yl]-2-thiophen-2-ylacetamide Traditional Name: N-[6-[4-(4-chlorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-pyridyl]-2-(2-thienyl)acetamide Formula: C22H23ClN4O3S2 MolecularWeight: 491.02602

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C3=NC=C(C=C3)NC(=O)CC4=CC=CS4

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C3=NC=C(C=C3)NC(=O)CC4=CC=CS4

InChI

InChI=1S/C22H23ClN4O3S2/c23-17-4-7-20(8-5-17)32(29,30)27-11-2-10-26(12-13-27)21-9-6-18(16-24-21)25-22(28)15-19-3-1-14-31-19/h1,3-9,14,16H,2,10-13,15H2,(H,25,28)