2-[2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoylamino]-N-(3-methylphenyl)benzamide

Systemtic Name: 2-[2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoylamino]-N-(3-methylphenyl)benzamide Openeye Name: 2-[[2-(4,6-diaminopyrimidin-2-yl)sulfanylacetyl]amino]-N-(m-tolyl)benzamide CAS Name: 2-[[2-[(4,6-diamino-2-pyrimidinyl)thio]-1-oxoethyl]amino]-N-(3-methylphenyl)benzamide IUPAC Name: 2-[[2-(4,6-diaminopyrimidin-2-yl)sulfanylacetyl]amino]-N-(3-methylphenyl)benzamide Traditional Name: 2-[[2-[(4,6-diaminopyrimidin-2-yl)thio]acetyl]amino]-N-(m-tolyl)benzamide Formula: C20H20N6O2S MolecularWeight: 408.4768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C20H20N6O2S/c1-12-5-4-6-13(9-12)23-19(28)14-7-2-3-8-15(14)24-18(27)11-29-20-25-16(21)10-17(22)26-20/h2-10H,11H2,1H3,(H,23,28)(H,24,27)(H4,21,22,25,26)