2-(1,3-benzothiazol-2-ylamino)-5-butyl-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-(1,3-benzothiazol-2-ylamino)-5-butyl-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-(1,3-benzothiazol-2-ylamino)-5-butyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-(1,3-benzothiazol-2-ylamino)-5-butyl-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-(1,3-benzothiazol-2-ylamino)-5-butyl-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-(1,3-benzothiazol-2-ylamino)-5-butyl-6-methyl-1H-pyrimidin-4-one Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=NC1=O)NC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CCCCC1=C(NC(=NC1=O)NC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C16H18N4OS/c1-3-4-7-11-10(2)17-15(19-14(11)21)20-16-18-12-8-5-6-9-13(12)22-16/h5-6,8-9H,3-4,7H2,1-2H3,(H2,17,18,19,20,21)