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

Systemtic Name: N-(7-chloranyl-4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenoxy-propanamide Openeye Name: N-(7-chloro-4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenoxy-propanamide CAS Name: N-(7-chloro-4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenoxypropanamide IUPAC Name: N-(7-chloro-4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenoxypropanamide Traditional Name: N-(7-chloro-4-methoxy-3-propargyl-1,3-benzothiazol-2-ylidene)-3-phenoxy-propionamide Formula: C20H17ClN2O3S MolecularWeight: 400.87858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)Cl)SC(=NC(=O)CCOC3=CC=CC=C3)N2CC#C

Isomeric SMILES

COC1=C2C(=C(C=C1)Cl)SC(=NC(=O)CCOC3=CC=CC=C3)N2CC#C

InChI

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