2-[cyclohexyl-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-amino]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[cyclohexyl-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-amino]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[cyclohexyl-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-amino]acetamide CAS Name: 2-[cyclohexyl-[4-(1-pyrrolidinylsulfonyl)phenyl]sulfonylamino]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[cyclohexyl-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylamino]acetamide Traditional Name: N-benzyl-2-[cyclohexyl-(4-pyrrolidinosulfonylphenyl)sulfonyl-amino]acetamide Formula: C25H33N3O5S2 MolecularWeight: 519.67662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC(=O)NCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

C1CCC(CC1)N(CC(=O)NCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C25H33N3O5S2/c29-25(26-19-21-9-3-1-4-10-21)20-28(22-11-5-2-6-12-22)35(32,33)24-15-13-23(14-16-24)34(30,31)27-17-7-8-18-27/h1,3-4,9-10,13-16,22H,2,5-8,11-12,17-20H2,(H,26,29)