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

Systemtic Name: 2-[(3-cyanophenyl)carbamoyl-cyclopropyl-amino]-N-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(3-cyanophenyl)carbamoyl-cyclopropyl-amino]-N-[(3-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[[(3-cyanoanilino)-oxomethyl]-cyclopropylamino]-N-[(3-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(3-cyanophenyl)carbamoyl-cyclopropylamino]-N-[(3-methylthiophen-2-yl)methyl]acetamide Traditional Name: N-benzyl-2-[(3-cyanophenyl)carbamoyl-cyclopropyl-amino]-N-[(3-methyl-2-thienyl)methyl]acetamide Formula: C26H26N4O2S MolecularWeight: 458.57524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(CC2=CC=CC=C2)C(=O)CN(C3CC3)C(=O)NC4=CC=CC(=C4)C#N

Isomeric SMILES

CC1=C(SC=C1)CN(CC2=CC=CC=C2)C(=O)CN(C3CC3)C(=O)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C26H26N4O2S/c1-19-12-13-33-24(19)17-29(16-20-6-3-2-4-7-20)25(31)18-30(23-10-11-23)26(32)28-22-9-5-8-21(14-22)15-27/h2-9,12-14,23H,10-11,16-18H2,1H3,(H,28,32)