2-[2-(benzotriazol-1-yl)ethanoyl-[4-(pyridin-3-ylmethylsulfamoyl)phenyl]amino]-N-cyclohexyl-2-thiophen-2-yl-ethanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-[4-(pyridin-3-ylmethylsulfamoyl)phenyl]amino]-N-cyclohexyl-2-thiophen-2-yl-ethanamide Openeye Name: 2-[N-[2-(benzotriazol-1-yl)acetyl]-4-(3-pyridylmethylsulfamoyl)anilino]-N-cyclohexyl-2-(2-thienyl)acetamide CAS Name: 2-[N-[2-(1-benzotriazolyl)-1-oxoethyl]-4-(3-pyridinylmethylsulfamoyl)anilino]-N-cyclohexyl-2-thiophen-2-ylacetamide IUPAC Name: 2-[N-[2-(benzotriazol-1-yl)acetyl]-4-(pyridin-3-ylmethylsulfamoyl)anilino]-N-cyclohexyl-2-thiophen-2-ylacetamide Traditional Name: 2-[N-[2-(benzotriazol-1-yl)acetyl]-4-(3-pyridylmethylsulfamoyl)anilino]-N-cyclohexyl-2-(2-thienyl)acetamide Formula: C32H33N7O4S2 MolecularWeight: 643.77892

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC=CS2)N(C3=CC=C(C=C3)S(=O)(=O)NCC4=CN=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC=CS2)N(C3=CC=C(C=C3)S(=O)(=O)NCC4=CN=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C32H33N7O4S2/c40-30(22-38-28-12-5-4-11-27(28)36-37-38)39(31(29-13-7-19-44-29)32(41)35-24-9-2-1-3-10-24)25-14-16-26(17-15-25)45(42,43)34-21-23-8-6-18-33-20-23/h4-8,11-20,24,31,34H,1-3,9-10,21-22H2,(H,35,41)