4-[[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylmethyl]-N-(4-methoxyphenyl)benzamide

Systemtic Name: 4-[[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylmethyl]-N-(4-methoxyphenyl)benzamide Openeye Name: 4-[(4,6-diaminopyrimidin-2-yl)sulfanylmethyl]-N-(4-methoxyphenyl)benzamide CAS Name: 4-[[(4,6-diamino-2-pyrimidinyl)thio]methyl]-N-(4-methoxyphenyl)benzamide IUPAC Name: 4-[(4,6-diaminopyrimidin-2-yl)sulfanylmethyl]-N-(4-methoxyphenyl)benzamide Traditional Name: 4-[[(4,6-diaminopyrimidin-2-yl)thio]methyl]-N-(4-methoxyphenyl)benzamide Formula: C19H19N5O2S MolecularWeight: 381.45146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C19H19N5O2S/c1-26-15-8-6-14(7-9-15)22-18(25)13-4-2-12(3-5-13)11-27-19-23-16(20)10-17(21)24-19/h2-10H,11H2,1H3,(H,22,25)(H4,20,21,23,24)