4-[(E)-2-(5,6-dimethyl-1,3-benzothiazol-2-yl)ethenyl]-1,5-dimethyl-pyrrole-2-carbonitrile

Systemtic Name: 4-[(E)-2-(5,6-dimethyl-1,3-benzothiazol-2-yl)ethenyl]-1,5-dimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[(E)-2-(5,6-dimethyl-1,3-benzothiazol-2-yl)vinyl]-1,5-dimethyl-pyrrole-2-carbonitrile CAS Name: 4-[(E)-2-(5,6-dimethyl-1,3-benzothiazol-2-yl)ethenyl]-1,5-dimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[(E)-2-(5,6-dimethyl-1,3-benzothiazol-2-yl)ethenyl]-1,5-dimethylpyrrole-2-carbonitrile Traditional Name: 4-[(E)-2-(5,6-dimethyl-1,3-benzothiazol-2-yl)vinyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C18H17N3S MolecularWeight: 307.41268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)C=CC3=C(N(C(=C3)C#N)C)C

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)/C=C/C3=C(N(C(=C3)C#N)C)C

InChI

InChI=1S/C18H17N3S/c1-11-7-16-17(8-12(11)2)22-18(20-16)6-5-14-9-15(10-19)21(4)13(14)3/h5-9H,1-4H3/b6-5+