2-[(4-cyanophenyl)carbamoyl-propan-2-yl-amino]-N-[(5-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(4-cyanophenyl)carbamoyl-propan-2-yl-amino]-N-[(5-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(4-cyanophenyl)carbamoyl-isopropyl-amino]-N-[(5-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[[(4-cyanoanilino)-oxomethyl]-propan-2-ylamino]-N-[(5-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4-cyanophenyl)carbamoyl-propan-2-ylamino]-N-[(5-methylthiophen-2-yl)methyl]acetamide Traditional Name: N-benzyl-2-[(4-cyanophenyl)carbamoyl-isopropyl-amino]-N-[(5-methyl-2-thienyl)methyl]acetamide Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CC2=CC=CC=C2)C(=O)CN(C(C)C)C(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC=C(S1)CN(CC2=CC=CC=C2)C(=O)CN(C(C)C)C(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C26H28N4O2S/c1-19(2)30(26(32)28-23-12-10-21(15-27)11-13-23)18-25(31)29(16-22-7-5-4-6-8-22)17-24-14-9-20(3)33-24/h4-14,19H,16-18H2,1-3H3,(H,28,32)