N-(5-chloranyl-4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3,4-dimethoxy-benzamide

Systemtic Name: N-(5-chloranyl-4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3,4-dimethoxy-benzamide Openeye Name: N-(5-chloro-4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3,4-dimethoxy-benzamide CAS Name: N-(5-chloro-4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3,4-dimethoxybenzamide IUPAC Name: N-(5-chloro-4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3,4-dimethoxybenzamide Traditional Name: N-(5-chloro-4-methyl-3-propargyl-1,3-benzothiazol-2-ylidene)-3,4-dimethoxy-benzamide Formula: C20H17ClN2O3S MolecularWeight: 400.87858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C(=NC(=O)C3=CC(=C(C=C3)OC)OC)S2)CC#C)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N(C(=NC(=O)C3=CC(=C(C=C3)OC)OC)S2)CC#C)Cl

InChI

InChI=1S/C20H17ClN2O3S/c1-5-10-23-18-12(2)14(21)7-9-17(18)27-20(23)22-19(24)13-6-8-15(25-3)16(11-13)26-4/h1,6-9,11H,10H2,2-4H3