(2Z)-2-(1,3-benzothiazol-2-yl)-2-[1-(3-methylbutyl)-2-oxidanylidene-indol-3-ylidene]ethanenitrile

Systemtic Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-[1-(3-methylbutyl)-2-oxidanylidene-indol-3-ylidene]ethanenitrile Openeye Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-(1-isopentyl-2-oxo-indolin-3-ylidene)acetonitrile CAS Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-[1-(3-methylbutyl)-2-oxo-3-indolylidene]acetonitrile IUPAC Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-[1-(3-methylbutyl)-2-oxoindol-3-ylidene]acetonitrile Traditional Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-(1-isoamyl-2-keto-indolin-3-ylidene)acetonitrile Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2C(=C(C#N)C3=NC4=CC=CC=C4S3)C1=O

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2/C(=C(\C#N)/C3=NC4=CC=CC=C4S3)/C1=O

InChI

InChI=1S/C22H19N3OS/c1-14(2)11-12-25-18-9-5-3-7-15(18)20(22(25)26)16(13-23)21-24-17-8-4-6-10-19(17)27-21/h3-10,14H,11-12H2,1-2H3/b20-16-