N-[4-azanyl-1-methyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-5-yl]carbothioylcyclopropanecarboxamide

Systemtic Name: N-[4-azanyl-1-methyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-5-yl]carbothioylcyclopropanecarboxamide Openeye Name: N-(6-amino-1-benzyl-3-methyl-2,4-dioxo-pyrimidine-5-carbothioyl)cyclopropanecarboxamide CAS Name: N-[[4-amino-1-methyl-2,6-dioxo-3-(phenylmethyl)-5-pyrimidinyl]-sulfanylidenemethyl]cyclopropanecarboxamide IUPAC Name: N-(6-amino-1-benzyl-3-methyl-2,4-dioxopyrimidine-5-carbothioyl)cyclopropanecarboxamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-3-methyl-pyrimidine-5-carbothioyl)cyclopropanecarboxamide Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N(C1=O)CC2=CC=CC=C2)N)C(=S)NC(=O)C3CC3

Isomeric SMILES

CN1C(=O)C(=C(N(C1=O)CC2=CC=CC=C2)N)C(=S)NC(=O)C3CC3

InChI

InChI=1S/C17H18N4O3S/c1-20-16(23)12(15(25)19-14(22)11-7-8-11)13(18)21(17(20)24)9-10-5-3-2-4-6-10/h2-6,11H,7-9,18H2,1H3,(H,19,22,25)