2-[(3-cyanophenyl)carbamoyl-(2-methylpropyl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[(3-cyanophenyl)carbamoyl-(2-methylpropyl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-benzyl-2-[(3-cyanophenyl)carbamoyl-isobutyl-amino]-N-(2-thienylmethyl)acetamide CAS Name: 2-[[(3-cyanoanilino)-oxomethyl]-(2-methylpropyl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-benzyl-2-[(3-cyanophenyl)carbamoyl-(2-methylpropyl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-benzyl-2-[(3-cyanophenyl)carbamoyl-isobutyl-amino]-N-(2-thenyl)acetamide Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CC(C)CN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C26H28N4O2S/c1-20(2)16-30(26(32)28-23-11-6-10-22(14-23)15-27)19-25(31)29(18-24-12-7-13-33-24)17-21-8-4-3-5-9-21/h3-14,20H,16-19H2,1-2H3,(H,28,32)