N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,4-dimethyl-benzamide

Systemtic Name: N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,4-dimethyl-benzamide Openeye Name: N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,4-dimethyl-benzamide CAS Name: N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,4-dimethylbenzamide IUPAC Name: N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,4-dimethylbenzamide Traditional Name: N-(4-methoxy-3-propargyl-1,3-benzothiazol-2-ylidene)-2,4-dimethyl-benzamide Formula: C20H18N2O2S MolecularWeight: 350.43412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)N=C2N(C3=C(C=CC=C3S2)OC)CC#C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N=C2N(C3=C(C=CC=C3S2)OC)CC#C)C

InChI

InChI=1S/C20H18N2O2S/c1-5-11-22-18-16(24-4)7-6-8-17(18)25-20(22)21-19(23)15-10-9-13(2)12-14(15)3/h1,6-10,12H,11H2,2-4H3