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

Systemtic Name: N-(phenylmethyl)-2-[(phenylmethyl)carbamoyl-prop-2-enyl-amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[allyl(benzylcarbamoyl)amino]-N-benzyl-N-(2-thienylmethyl)acetamide CAS Name: 2-[[oxo-[(phenylmethyl)amino]methyl]-prop-2-enylamino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-benzyl-2-[benzylcarbamoyl(prop-2-enyl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[allyl(benzylcarbamoyl)amino]-N-benzyl-N-(2-thenyl)acetamide Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C=CCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C25H27N3O2S/c1-2-15-27(25(30)26-17-21-10-5-3-6-11-21)20-24(29)28(19-23-14-9-16-31-23)18-22-12-7-4-8-13-22/h2-14,16H,1,15,17-20H2,(H,26,30)