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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]carbothioyl-3-thiophen-2-yl-prop-2-enamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidine-5-carbothioyl)-3-(2-thienyl)prop-2-enamide CAS Name: N-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-sulfanylidenemethyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidine-5-carbothioyl)-3-thiophen-2-ylprop-2-enamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidine-5-carbothioyl)-3-(2-thienyl)acrylamide Formula: C16H18N4O3S2 MolecularWeight: 378.46912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)C(=S)NC(=O)C=CC2=CC=CS2)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)C(=S)NC(=O)C=CC2=CC=CS2)N

InChI

InChI=1S/C16H18N4O3S2/c1-2-3-8-20-13(17)12(14(22)19-16(20)23)15(24)18-11(21)7-6-10-5-4-9-25-10/h4-7,9H,2-3,8,17H2,1H3,(H,18,21,24)(H,19,22,23)