2-[[6-methyl-4-oxidanylidene-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-2-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[6-methyl-4-oxidanylidene-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-[(4-isopropoxyphenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]sulfanyl]acetamide CAS Name: 2-[[6-methyl-4-oxo-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-2-yl]thio]acetamide IUPAC Name: 2-[[6-methyl-4-oxo-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-2-yl]sulfanyl]acetamide Traditional Name: 2-[[5-(4-isopropoxybenzyl)-4-keto-6-methyl-1H-pyrimidin-2-yl]thio]acetamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC(=O)N)CC2=CC=C(C=C2)OC(C)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC(=O)N)CC2=CC=C(C=C2)OC(C)C

InChI

InChI=1S/C17H21N3O3S/c1-10(2)23-13-6-4-12(5-7-13)8-14-11(3)19-17(20-16(14)22)24-9-15(18)21/h4-7,10H,8-9H2,1-3H3,(H2,18,21)(H,19,20,22)