1-(4-chloranyl-1,3-benzothiazol-2-yl)-3-(2,5-dimethylphenyl)thiourea

Systemtic Name: 1-(4-chloranyl-1,3-benzothiazol-2-yl)-3-(2,5-dimethylphenyl)thiourea Openeye Name: 1-(4-chloro-1,3-benzothiazol-2-yl)-3-(2,5-dimethylphenyl)thiourea CAS Name: 1-(4-chloro-1,3-benzothiazol-2-yl)-3-(2,5-dimethylphenyl)thiourea IUPAC Name: 1-(4-chloro-1,3-benzothiazol-2-yl)-3-(2,5-dimethylphenyl)thiourea Traditional Name: 1-(4-chloro-1,3-benzothiazol-2-yl)-3-(2,5-dimethylphenyl)thiourea Formula: C16H14ClN3S2 MolecularWeight: 347.88546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)NC2=NC3=C(S2)C=CC=C3Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)NC2=NC3=C(S2)C=CC=C3Cl

InChI

InChI=1S/C16H14ClN3S2/c1-9-6-7-10(2)12(8-9)18-15(21)20-16-19-14-11(17)4-3-5-13(14)22-16/h3-8H,1-2H3,(H2,18,19,20,21)