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

Systemtic Name: 2-[(3-ethylphenyl)carbamoyl-prop-2-enyl-amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[allyl-[(3-ethylphenyl)carbamoyl]amino]-N-benzyl-N-(2-thienylmethyl)acetamide CAS Name: 2-[[(3-ethylanilino)-oxomethyl]-prop-2-enylamino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-benzyl-2-[(3-ethylphenyl)carbamoyl-prop-2-enylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[allyl-[(3-ethylphenyl)carbamoyl]amino]-N-benzyl-N-(2-thenyl)acetamide Formula: C26H29N3O2S MolecularWeight: 447.59236

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)N(CC=C)CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)N(CC=C)CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3

InChI

InChI=1S/C26H29N3O2S/c1-3-15-28(26(31)27-23-13-8-12-21(4-2)17-23)20-25(30)29(19-24-14-9-16-32-24)18-22-10-6-5-7-11-22/h3,5-14,16-17H,1,4,15,18-20H2,2H3,(H,27,31)