N-[(5-methylthiophen-2-yl)methyl]-N-(phenylmethyl)-2-[(phenylmethyl)carbamoyl-prop-2-enyl-amino]ethanamide

Systemtic Name: N-[(5-methylthiophen-2-yl)methyl]-N-(phenylmethyl)-2-[(phenylmethyl)carbamoyl-prop-2-enyl-amino]ethanamide Openeye Name: 2-[allyl(benzylcarbamoyl)amino]-N-benzyl-N-[(5-methyl-2-thienyl)methyl]acetamide CAS Name: N-[(5-methyl-2-thiophenyl)methyl]-2-[[oxo-[(phenylmethyl)amino]methyl]-prop-2-enylamino]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[benzylcarbamoyl(prop-2-enyl)amino]-N-[(5-methylthiophen-2-yl)methyl]acetamide Traditional Name: 2-[allyl(benzylcarbamoyl)amino]-N-benzyl-N-[(5-methyl-2-thienyl)methyl]acetamide Formula: C26H29N3O2S MolecularWeight: 447.59236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CC2=CC=CC=C2)C(=O)CN(CC=C)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(S1)CN(CC2=CC=CC=C2)C(=O)CN(CC=C)C(=O)NCC3=CC=CC=C3

InChI

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