N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]carbothioyl-3,3-diphenyl-propanamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]carbothioyl-3,3-diphenyl-propanamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidine-5-carbothioyl)-3,3-diphenyl-propanamide CAS Name: N-[[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-sulfanylidenemethyl]-3,3-diphenylpropanamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidine-5-carbothioyl)-3,3-diphenylpropanamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidine-5-carbothioyl)-3,3-diphenyl-propionamide Formula: C27H24N4O3S MolecularWeight: 484.56946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(C(=O)NC2=O)C(=S)NC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(C(=O)NC2=O)C(=S)NC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C27H24N4O3S/c28-24-23(25(33)30-27(34)31(24)17-18-10-4-1-5-11-18)26(35)29-22(32)16-21(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21H,16-17,28H2,(H,29,32,35)(H,30,33,34)