3-[(E)-3-(1,3-benzothiazol-2-yl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 3-[(E)-3-(1,3-benzothiazol-2-yl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 3-[(E)-3-(1,3-benzothiazol-2-yl)-3-oxo-prop-1-enyl]benzonitrile CAS Name: 3-[(E)-3-(1,3-benzothiazol-2-yl)-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 3-[(E)-3-(1,3-benzothiazol-2-yl)-3-oxoprop-1-enyl]benzonitrile Traditional Name: 3-[(E)-3-(1,3-benzothiazol-2-yl)-3-keto-prop-1-enyl]benzonitrile Formula: C17H10N2OS MolecularWeight: 290.3391

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=O)C=CC3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C(=O)/C=C/C3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H10N2OS/c18-11-13-5-3-4-12(10-13)8-9-15(20)17-19-14-6-1-2-7-16(14)21-17/h1-10H/b9-8+