N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-2-(2-cyanophenyl)sulfanyl-N-methyl-benzamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-2-(2-cyanophenyl)sulfanyl-N-methyl-benzamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-2-(2-cyanophenyl)sulfanyl-N-methyl-benzamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-2-[(2-cyanophenyl)thio]-N-methylbenzamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-2-(2-cyanophenyl)sulfanyl-N-methylbenzamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-2-[(2-cyanophenyl)thio]-N-methyl-benzamide Formula: C26H21N5O3S MolecularWeight: 483.54164

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3=CC=CC=C3SC4=CC=CC=C4C#N

Isomeric SMILES

CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3=CC=CC=C3SC4=CC=CC=C4C#N

InChI

InChI=1S/C26H21N5O3S/c1-30(22-23(28)31(26(34)29-24(22)32)16-17-9-3-2-4-10-17)25(33)19-12-6-8-14-21(19)35-20-13-7-5-11-18(20)15-27/h2-14H,16,28H2,1H3,(H,29,32,34)