2-[(3,4-dimethylphenyl)carbamoyl-propan-2-yl-amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[(3,4-dimethylphenyl)carbamoyl-propan-2-yl-amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-benzyl-2-[(3,4-dimethylphenyl)carbamoyl-isopropyl-amino]-N-(2-thienylmethyl)acetamide CAS Name: 2-[[(3,4-dimethylanilino)-oxomethyl]-propan-2-ylamino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-benzyl-2-[(3,4-dimethylphenyl)carbamoyl-propan-2-ylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-benzyl-2-[(3,4-dimethylphenyl)carbamoyl-isopropyl-amino]-N-(2-thenyl)acetamide Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N(CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3)C(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N(CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3)C(C)C)C

InChI

InChI=1S/C26H31N3O2S/c1-19(2)29(26(31)27-23-13-12-20(3)21(4)15-23)18-25(30)28(17-24-11-8-14-32-24)16-22-9-6-5-7-10-22/h5-15,19H,16-18H2,1-4H3,(H,27,31)