5-methyl-3-[(4-propan-2-ylphenyl)carbamoyl]-[1,2]thiazolo[4,3-d]pyrimidin-7-olate

Systemtic Name: 5-methyl-3-[(4-propan-2-ylphenyl)carbamoyl]-[1,2]thiazolo[4,3-d]pyrimidin-7-olate Openeye Name: 3-[(4-isopropylphenyl)carbamoyl]-5-methyl-isothiazolo[4,3-d]pyrimidin-7-olate CAS Name: 5-methyl-3-[oxo-(4-propan-2-ylanilino)methyl]-7-isothiazolo[4,3-d]pyrimidinolate IUPAC Name: 5-methyl-3-[(4-propan-2-ylphenyl)carbamoyl]-[1,2]thiazolo[4,3-d]pyrimidin-7-olate Traditional Name: 5-methyl-3-(p-cumenylcarbamoyl)isothiazolo[4,3-d]pyrimidin-7-olate Formula: C16H15N4O2S- MolecularWeight: 327.3809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(SN=C2C(=N1)[O-])C(=O)NC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=NC2=C(SN=C2C(=N1)[O-])C(=O)NC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C16H16N4O2S/c1-8(2)10-4-6-11(7-5-10)19-16(22)14-12-13(20-23-14)15(21)18-9(3)17-12/h4-8H,1-3H3,(H,19,22)(H,17,18,21)/p-1