(4R)-4-[2-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-6-methyl-N-(phenylmethyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: (4R)-4-[2-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-6-methyl-N-(phenylmethyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: (4R)-4-[2-(2-amino-2-oxo-ethoxy)phenyl]-N-benzyl-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: (4R)-4-[2-(2-amino-2-oxoethoxy)phenyl]-6-methyl-N-(phenylmethyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: (4R)-4-[2-(2-amino-2-oxoethoxy)phenyl]-N-benzyl-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: (4R)-4-[2-(2-amino-2-keto-ethoxy)phenyl]-N-benzyl-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC=CC=C2OCC(=O)N)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C([C@H](NC(=S)N1)C2=CC=CC=C2OCC(=O)N)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O3S/c1-13-18(20(27)23-11-14-7-3-2-4-8-14)19(25-21(29)24-13)15-9-5-6-10-16(15)28-12-17(22)26/h2-10,19H,11-12H2,1H3,(H2,22,26)(H,23,27)(H2,24,25,29)/t19-/m1/s1