2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-ethanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-ethanamide Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-acetamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-[(3,4-dimethoxyphenyl)methyl]-N-ethylacetamide IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]-N-ethylacetamide Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-N-ethyl-N-veratryl-acetamide Formula: C17H23N5O3S MolecularWeight: 377.46122

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)OC)C(=O)CSC2=NC(=CC(=N2)N)N

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)OC)C(=O)CSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C17H23N5O3S/c1-4-22(9-11-5-6-12(24-2)13(7-11)25-3)16(23)10-26-17-20-14(18)8-15(19)21-17/h5-8H,4,9-10H2,1-3H3,(H4,18,19,20,21)