(2R)-2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]propanamide

Systemtic Name: (2R)-2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]propanamide Openeye Name: (2R)-2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]propanamide CAS Name: (2R)-2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-[(4-methoxyphenyl)methyl]propanamide IUPAC Name: (2R)-2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]propanamide Traditional Name: (2R)-2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-p-anisyl-propionamide Formula: C15H18N4O3S MolecularWeight: 334.39342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)OC)SC2=NC(=O)C=C(N2)N

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=C(C=C1)OC)SC2=NC(=O)C=C(N2)N

InChI

InChI=1S/C15H18N4O3S/c1-9(23-15-18-12(16)7-13(20)19-15)14(21)17-8-10-3-5-11(22-2)6-4-10/h3-7,9H,8H2,1-2H3,(H,17,21)(H3,16,18,19,20)/t9-/m1/s1