2-[2-(benzotriazol-1-yl)ethanoyl-(4-pyrrolidin-1-ylsulfonylphenyl)amino]-N-cyclohexyl-2-phenyl-ethanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(4-pyrrolidin-1-ylsulfonylphenyl)amino]-N-cyclohexyl-2-phenyl-ethanamide Openeye Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-4-pyrrolidin-1-ylsulfonyl-anilino)-N-cyclohexyl-2-phenyl-acetamide CAS Name: 2-[N-[2-(1-benzotriazolyl)-1-oxoethyl]-4-(1-pyrrolidinylsulfonyl)anilino]-N-cyclohexyl-2-phenylacetamide IUPAC Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-4-pyrrolidin-1-ylsulfonylanilino)-N-cyclohexyl-2-phenylacetamide Traditional Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-4-pyrrolidinosulfonyl-anilino)-N-cyclohexyl-2-phenyl-acetamide Formula: C32H36N6O4S MolecularWeight: 600.73104

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC=CC=C2)N(C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C(=O)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC=CC=C2)N(C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C(=O)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C32H36N6O4S/c39-30(23-37-29-16-8-7-15-28(29)34-35-37)38(26-17-19-27(20-18-26)43(41,42)36-21-9-10-22-36)31(24-11-3-1-4-12-24)32(40)33-25-13-5-2-6-14-25/h1,3-4,7-8,11-12,15-20,25,31H,2,5-6,9-10,13-14,21-23H2,(H,33,40)