2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]ethanamide Openeye Name: N-cyclopropyl-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide CAS Name: N-cyclopropyl-2-[(4,6-diamino-2-pyrimidinyl)thio]-N-[(4-methoxyphenyl)methyl]acetamide IUPAC Name: N-cyclopropyl-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide Traditional Name: N-cyclopropyl-2-[(4,6-diaminopyrimidin-2-yl)thio]-N-p-anisyl-acetamide Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(C2CC2)C(=O)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

COC1=CC=C(C=C1)CN(C2CC2)C(=O)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C17H21N5O2S/c1-24-13-6-2-11(3-7-13)9-22(12-4-5-12)16(23)10-25-17-20-14(18)8-15(19)21-17/h2-3,6-8,12H,4-5,9-10H2,1H3,(H4,18,19,20,21)