2-[(3-cyanophenyl)carbamoyl-prop-2-enyl-amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[(3-cyanophenyl)carbamoyl-prop-2-enyl-amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[allyl-[(3-cyanophenyl)carbamoyl]amino]-N-benzyl-N-(2-thienylmethyl)acetamide CAS Name: 2-[[(3-cyanoanilino)-oxomethyl]-prop-2-enylamino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-benzyl-2-[(3-cyanophenyl)carbamoyl-prop-2-enylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[allyl-[(3-cyanophenyl)carbamoyl]amino]-N-benzyl-N-(2-thenyl)acetamide Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24N4O2S/c1-2-13-28(25(31)27-22-11-6-10-21(15-22)16-26)19-24(30)29(18-23-12-7-14-32-23)17-20-8-4-3-5-9-20/h2-12,14-15H,1,13,17-19H2,(H,27,31)