2-[(4-acetamidophenyl)sulfonyl-(2-pyrrolidin-1-ylethyl)amino]-N-[(4-fluorophenyl)methyl]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[(4-acetamidophenyl)sulfonyl-(2-pyrrolidin-1-ylethyl)amino]-N-[(4-fluorophenyl)methyl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[(4-acetamidophenyl)sulfonyl-(2-pyrrolidin-1-ylethyl)amino]-N-[(4-fluorophenyl)methyl]-N-(2-thienylmethyl)acetamide CAS Name: 2-[(4-acetamidophenyl)sulfonyl-[2-(1-pyrrolidinyl)ethyl]amino]-N-[(4-fluorophenyl)methyl]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[(4-acetamidophenyl)sulfonyl-(2-pyrrolidin-1-ylethyl)amino]-N-[(4-fluorophenyl)methyl]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[(4-acetamidophenyl)sulfonyl-(2-pyrrolidinoethyl)amino]-N-(4-fluorobenzyl)-N-(2-thenyl)acetamide Formula: C28H33FN4O4S2 MolecularWeight: 572.714423

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CCN2CCCC2)CC(=O)N(CC3=CC=C(C=C3)F)CC4=CC=CS4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CCN2CCCC2)CC(=O)N(CC3=CC=C(C=C3)F)CC4=CC=CS4

InChI

InChI=1S/C28H33FN4O4S2/c1-22(34)30-25-10-12-27(13-11-25)39(36,37)33(17-16-31-14-2-3-15-31)21-28(35)32(20-26-5-4-18-38-26)19-23-6-8-24(29)9-7-23/h4-13,18H,2-3,14-17,19-21H2,1H3,(H,30,34)