2-[(4-cyanophenyl)carbamoyl-propyl-amino]-N-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(4-cyanophenyl)carbamoyl-propyl-amino]-N-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(4-cyanophenyl)carbamoyl-propyl-amino]-N-[(3-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[[(4-cyanoanilino)-oxomethyl]-propylamino]-N-[(3-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4-cyanophenyl)carbamoyl-propylamino]-N-[(3-methylthiophen-2-yl)methyl]acetamide Traditional Name: N-benzyl-2-[(4-cyanophenyl)carbamoyl-propyl-amino]-N-[(3-methyl-2-thienyl)methyl]acetamide Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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