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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31N3O2S2/c1-3-4-16-28(26(31)27-22-12-14-23(32-2)15-13-22)20-25(30)29(19-24-11-8-17-33-24)18-21-9-6-5-7-10-21/h5-15,17H,3-4,16,18-20H2,1-2H3,(H,27,31)