2-[2-[6-azanyl-1-(3-methylphenyl)-4-oxidanylidene-pyrimidin-2-yl]sulfanylethanoylamino]benzamide

Systemtic Name: 2-[2-[6-azanyl-1-(3-methylphenyl)-4-oxidanylidene-pyrimidin-2-yl]sulfanylethanoylamino]benzamide Openeye Name: 2-[[2-[6-amino-1-(m-tolyl)-4-oxo-pyrimidin-2-yl]sulfanylacetyl]amino]benzamide CAS Name: 2-[[2-[[6-amino-1-(3-methylphenyl)-4-oxo-2-pyrimidinyl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 2-[[2-[6-amino-1-(3-methylphenyl)-4-oxopyrimidin-2-yl]sulfanylacetyl]amino]benzamide Traditional Name: 2-[[2-[[6-amino-4-keto-1-(m-tolyl)pyrimidin-2-yl]thio]acetyl]amino]benzamide Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=O)N=C2SCC(=O)NC3=CC=CC=C3C(=O)N)N

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=O)N=C2SCC(=O)NC3=CC=CC=C3C(=O)N)N

InChI

InChI=1S/C20H19N5O3S/c1-12-5-4-6-13(9-12)25-16(21)10-17(26)24-20(25)29-11-18(27)23-15-8-3-2-7-14(15)19(22)28/h2-10H,11,21H2,1H3,(H2,22,28)(H,23,27)