(E)-N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-ethyl-3-thiophen-3-yl-prop-2-enamide

Systemtic Name: (E)-N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-ethyl-3-thiophen-3-yl-prop-2-enamide Openeye Name: (E)-N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-N-ethyl-3-(3-thienyl)prop-2-enamide CAS Name: (E)-N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-N-ethyl-3-(3-thiophenyl)-2-propenamide IUPAC Name: (E)-N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-ethyl-3-thiophen-3-ylprop-2-enamide Traditional Name: (E)-N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-ethyl-3-(3-thienyl)acrylamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C=CC3=CSC=C3

Isomeric SMILES

CCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)/C=C/C3=CSC=C3

InChI

InChI=1S/C20H20N4O3S/c1-2-23(16(25)9-8-15-10-11-28-13-15)17-18(21)24(20(27)22-19(17)26)12-14-6-4-3-5-7-14/h3-11,13H,2,12,21H2,1H3,(H,22,26,27)/b9-8+