1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(3-methylphenyl)thiourea

Systemtic Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(3-methylphenyl)thiourea Openeye Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(m-tolyl)thiourea CAS Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(3-methylphenyl)thiourea IUPAC Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(3-methylphenyl)thiourea Traditional Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(m-tolyl)thiourea Formula: C17H17N3S2 MolecularWeight: 327.46698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NC2=NC3=C(S2)C=C(C(=C3)C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NC2=NC3=C(S2)C=C(C(=C3)C)C

InChI

InChI=1S/C17H17N3S2/c1-10-5-4-6-13(7-10)18-16(21)20-17-19-14-8-11(2)12(3)9-15(14)22-17/h4-9H,1-3H3,(H2,18,19,20,21)