1-(3-chloranyl-2-methyl-phenyl)-3-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea Formula: C16H18ClN3S2 MolecularWeight: 351.91722

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=N2)NC(=S)NC3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CC1CCC2=C(C1)SC(=N2)NC(=S)NC3=C(C(=CC=C3)Cl)C

InChI

InChI=1S/C16H18ClN3S2/c1-9-6-7-13-14(8-9)22-16(19-13)20-15(21)18-12-5-3-4-11(17)10(12)2/h3-5,9H,6-8H2,1-2H3,(H2,18,19,20,21)