2-[(4-ethylphenyl)carbamoyl-prop-2-enyl-amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[(4-ethylphenyl)carbamoyl-prop-2-enyl-amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[allyl-[(4-ethylphenyl)carbamoyl]amino]-N-benzyl-N-(2-thienylmethyl)acetamide CAS Name: 2-[[(4-ethylanilino)-oxomethyl]-prop-2-enylamino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4-ethylphenyl)carbamoyl-prop-2-enylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[allyl-[(4-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=C(C=C1)NC(=O)N(CC=C)CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3

Isomeric SMILES

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

InChI

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