1-(3-chloranyl-2-methyl-phenyl)-3-(5,6-dimethyl-1,3-benzothiazol-2-yl)thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-(5,6-dimethyl-1,3-benzothiazol-2-yl)thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-(5,6-dimethyl-1,3-benzothiazol-2-yl)thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-(5,6-dimethyl-1,3-benzothiazol-2-yl)thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-(5,6-dimethyl-1,3-benzothiazol-2-yl)thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-(5,6-dimethyl-1,3-benzothiazol-2-yl)thiourea Formula: C17H16ClN3S2 MolecularWeight: 361.91204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)NC(=S)NC3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)NC(=S)NC3=C(C(=CC=C3)Cl)C

InChI

InChI=1S/C17H16ClN3S2/c1-9-7-14-15(8-10(9)2)23-17(20-14)21-16(22)19-13-6-4-5-12(18)11(13)3/h4-8H,1-3H3,(H2,19,20,21,22)