2-[2-methylpropyl-[(4-methylsulfanylphenyl)carbamoyl]amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[2-methylpropyl-[(4-methylsulfanylphenyl)carbamoyl]amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-benzyl-2-[isobutyl-[(4-methylsulfanylphenyl)carbamoyl]amino]-N-(2-thienylmethyl)acetamide CAS Name: 2-[2-methylpropyl-[[4-(methylthio)anilino]-oxomethyl]amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-benzyl-2-[2-methylpropyl-[(4-methylsulfanylphenyl)carbamoyl]amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-benzyl-2-[isobutyl-[[4-(methylthio)phenyl]carbamoyl]amino]-N-(2-thenyl)acetamide Formula: C26H31N3O2S2 MolecularWeight: 481.67324

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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=C(C=C3)SC

Isomeric SMILES

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

InChI

InChI=1S/C26H31N3O2S2/c1-20(2)16-29(26(31)27-22-11-13-23(32-3)14-12-22)19-25(30)28(18-24-10-7-15-33-24)17-21-8-5-4-6-9-21/h4-15,20H,16-19H2,1-3H3,(H,27,31)