2-butyl-3-methyl-1-oxidanylidene-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile

Systemtic Name: 2-butyl-3-methyl-1-oxidanylidene-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile Openeye Name: 2-butyl-3-methyl-1-oxo-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile CAS Name: 2-butyl-3-methyl-1-oxo-4-pyrido[2,1-b][1,3]benzothiazolecarbonitrile IUPAC Name: 2-butyl-3-methyl-1-oxopyrido[2,1-b][1,3]benzothiazole-4-carbonitrile Traditional Name: 2-butyl-1-keto-3-methyl-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile Formula: C17H16N2OS MolecularWeight: 296.38674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C2N(C1=O)C3=CC=CC=C3S2)C#N)C

Isomeric SMILES

CCCCC1=C(C(=C2N(C1=O)C3=CC=CC=C3S2)C#N)C

InChI

InChI=1S/C17H16N2OS/c1-3-4-7-12-11(2)13(10-18)17-19(16(12)20)14-8-5-6-9-15(14)21-17/h5-6,8-9H,3-4,7H2,1-2H3