6,7-dimethyl-4-pentyl-pyrimido[2,1-b][1,3]benzothiazol-2-one

Systemtic Name: 6,7-dimethyl-4-pentyl-pyrimido[2,1-b][1,3]benzothiazol-2-one Openeye Name: 6,7-dimethyl-4-pentyl-pyrimido[2,1-b][1,3]benzothiazol-2-one CAS Name: 6,7-dimethyl-4-pentyl-2-pyrimido[2,1-b][1,3]benzothiazolone IUPAC Name: 6,7-dimethyl-4-pentylpyrimido[2,1-b][1,3]benzothiazol-2-one Traditional Name: 4-amyl-6,7-dimethyl-pyrimido[2,1-b][1,3]benzothiazol-2-one Formula: C17H20N2OS MolecularWeight: 300.4185

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=O)N=C2N1C3=C(S2)C=CC(=C3C)C

Isomeric SMILES

CCCCCC1=CC(=O)N=C2N1C3=C(S2)C=CC(=C3C)C

InChI

InChI=1S/C17H20N2OS/c1-4-5-6-7-13-10-15(20)18-17-19(13)16-12(3)11(2)8-9-14(16)21-17/h8-10H,4-7H2,1-3H3