1-(4-chloranyl-1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)thiourea

Systemtic Name: 1-(4-chloranyl-1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)thiourea Openeye Name: 1-(4-chloro-1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)thiourea CAS Name: 1-(4-chloro-1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)thiourea IUPAC Name: 1-(4-chloro-1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)thiourea Traditional Name: 1-(4-chloro-1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)thiourea Formula: C16H14ClN3O2S2 MolecularWeight: 379.88426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NC2=NC3=C(S2)C=CC=C3Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC2=NC3=C(S2)C=CC=C3Cl)OC

InChI

InChI=1S/C16H14ClN3O2S2/c1-21-11-7-6-9(8-12(11)22-2)18-15(23)20-16-19-14-10(17)4-3-5-13(14)24-16/h3-8H,1-2H3,(H2,18,19,20,23)