2-[(E)-3-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-chlorophenyl)prop-2-enylidene]propanedinitrile

Systemtic Name: 2-[(E)-3-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-chlorophenyl)prop-2-enylidene]propanedinitrile Openeye Name: 2-[(E)-3-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-chlorophenyl)prop-2-enylidene]propanedinitrile CAS Name: 2-[(E)-3-(1,3-benzothiazol-2-ylthio)-3-(4-chlorophenyl)prop-2-enylidene]propanedinitrile IUPAC Name: 2-[(E)-3-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-chlorophenyl)prop-2-enylidene]propanedinitrile Traditional Name: 2-[(E)-3-(1,3-benzothiazol-2-ylthio)-3-(4-chlorophenyl)prop-2-enylidene]malononitrile Formula: C19H10ClN3S2 MolecularWeight: 379.8858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC(=CC=C(C#N)C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H10ClN3S2/c20-15-8-6-14(7-9-15)17(10-5-13(11-21)12-22)24-19-23-16-3-1-2-4-18(16)25-19/h1-10H/b17-10+