(E)-2-(1,3-benzothiazol-2-yl)-3-(2-phenyl-1,2,3-triazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(2-phenyl-1,2,3-triazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(2-phenyltriazol-4-yl)prop-2-enenitrile CAS Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(2-phenyl-4-triazolyl)-2-propenenitrile IUPAC Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(2-phenyltriazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(2-phenyltriazol-4-yl)acrylonitrile Formula: C18H11N5S MolecularWeight: 329.37844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=CC(=N2)C=C(C#N)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)N2N=CC(=N2)/C=C(\C#N)/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H11N5S/c19-11-13(18-21-16-8-4-5-9-17(16)24-18)10-14-12-20-23(22-14)15-6-2-1-3-7-15/h1-10,12H/b13-10+