4-[(E)-3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-oxo-prop-1-enyl]benzonitrile CAS Name: 4-[(E)-3-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 4-[(E)-3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxoprop-1-enyl]benzonitrile Traditional Name: 4-[(E)-3-[4-(1,3-benzothiazol-2-yl)piperidino]-3-keto-prop-1-enyl]benzonitrile Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)C=CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)/C=C/C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H19N3OS/c23-15-17-7-5-16(6-8-17)9-10-21(26)25-13-11-18(12-14-25)22-24-19-3-1-2-4-20(19)27-22/h1-10,18H,11-14H2/b10-9+