(E)-2-(5-chloranyl-1,3-benzothiazol-2-yl)-3-(1-methylpyrazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(5-chloranyl-1,3-benzothiazol-2-yl)-3-(1-methylpyrazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-(5-chloro-1,3-benzothiazol-2-yl)-3-(1-methylpyrazol-4-yl)prop-2-enenitrile CAS Name: (E)-2-(5-chloro-1,3-benzothiazol-2-yl)-3-(1-methyl-4-pyrazolyl)-2-propenenitrile IUPAC Name: (E)-2-(5-chloro-1,3-benzothiazol-2-yl)-3-(1-methylpyrazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-(5-chloro-1,3-benzothiazol-2-yl)-3-(1-methylpyrazol-4-yl)acrylonitrile Formula: C14H9ClN4S MolecularWeight: 300.76606

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C=C(C#N)C2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

CN1C=C(C=N1)/C=C(\C#N)/C2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C14H9ClN4S/c1-19-8-9(7-17-19)4-10(6-16)14-18-12-5-11(15)2-3-13(12)20-14/h2-5,7-8H,1H3/b10-4+