N-(7-chloranyl-4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3,4-dimethoxy-benzamide

Systemtic Name: N-(7-chloranyl-4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3,4-dimethoxy-benzamide Openeye Name: N-(7-chloro-4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3,4-dimethoxy-benzamide CAS Name: N-(7-chloro-4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3,4-dimethoxybenzamide IUPAC Name: N-(7-chloro-4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3,4-dimethoxybenzamide Traditional Name: N-(7-chloro-4-methoxy-3-propargyl-1,3-benzothiazol-2-ylidene)-3,4-dimethoxy-benzamide Formula: C20H17ClN2O4S MolecularWeight: 416.87798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N=C2N(C3=C(C=CC(=C3S2)Cl)OC)CC#C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N=C2N(C3=C(C=CC(=C3S2)Cl)OC)CC#C)OC

InChI

InChI=1S/C20H17ClN2O4S/c1-5-10-23-17-15(26-3)9-7-13(21)18(17)28-20(23)22-19(24)12-6-8-14(25-2)16(11-12)27-4/h1,6-9,11H,10H2,2-4H3