2-(1,3-benzothiazol-2-yl)-3-[(2,4-dimethoxyphenyl)amino]prop-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-3-[(2,4-dimethoxyphenyl)amino]prop-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-3-(2,4-dimethoxyanilino)prop-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-3-(2,4-dimethoxyanilino)-2-propenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-3-(2,4-dimethoxyanilino)prop-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-3-(2,4-dimethoxyanilino)acrylonitrile Formula: C18H15N3O2S MolecularWeight: 337.3956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC=C(C#N)C2=NC3=CC=CC=C3S2)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC=C(C#N)C2=NC3=CC=CC=C3S2)OC

InChI

InChI=1S/C18H15N3O2S/c1-22-13-7-8-14(16(9-13)23-2)20-11-12(10-19)18-21-15-5-3-4-6-17(15)24-18/h3-9,11,20H,1-2H3