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

Systemtic Name: 2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]propanamide Openeye Name: 2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]propanamide CAS Name: 2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-N-[(3,4-dimethoxyphenyl)methyl]propanamide IUPAC Name: 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]propanamide Traditional Name: 2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-N-veratryl-propionamide Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(C)C(=O)NCC2=CC(=C(C=C2)OC)OC)N

Isomeric SMILES

CC1=CC(=NC(=N1)SC(C)C(=O)NCC2=CC(=C(C=C2)OC)OC)N

InChI

InChI=1S/C17H22N4O3S/c1-10-7-15(18)21-17(20-10)25-11(2)16(22)19-9-12-5-6-13(23-3)14(8-12)24-4/h5-8,11H,9H2,1-4H3,(H,19,22)(H2,18,20,21)