(E)-N-[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-3-phenyl-N-prop-2-enyl-prop-2-enamide

Systemtic Name: (E)-N-[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-3-phenyl-N-prop-2-enyl-prop-2-enamide Openeye Name: (E)-N-allyl-N-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[2-[(5-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-3-phenyl-N-prop-2-enyl-2-propenamide IUPAC Name: (E)-N-[2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-3-phenyl-N-prop-2-enylprop-2-enamide Traditional Name: (E)-N-allyl-N-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-3-phenyl-acrylamide Formula: C27H28N2O2S MolecularWeight: 444.58842

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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)C=CC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C27H28N2O2S/c1-3-18-28(26(30)17-15-23-10-6-4-7-11-23)21-27(31)29(19-24-12-8-5-9-13-24)20-25-16-14-22(2)32-25/h3-17H,1,18-21H2,2H3/b17-15+