1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(2-methylbutan-2-yl)thiourea

Systemtic Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(2-methylbutan-2-yl)thiourea Openeye Name: 1-(1,1-dimethylpropyl)-3-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]thiourea CAS Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(2-methylbutan-2-yl)thiourea IUPAC Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(2-methylbutan-2-yl)thiourea Traditional Name: 1-tert-amyl-3-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]thiourea Formula: C20H23N3S2 MolecularWeight: 369.54672

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=S)NC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)C

Isomeric SMILES

CCC(C)(C)NC(=S)NC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)C

InChI

InChI=1S/C20H23N3S2/c1-5-20(3,4)23-19(24)21-15-9-7-14(8-10-15)18-22-16-11-6-13(2)12-17(16)25-18/h6-12H,5H2,1-4H3,(H2,21,23,24)