1-(3-chloranyl-4-methyl-phenyl)-3-(2-methylpropyl)thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-(2-methylpropyl)thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-isobutyl-thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-(2-methylpropyl)thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-(2-methylpropyl)thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-isobutyl-thiourea Formula: C12H17ClN2S MolecularWeight: 256.79478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCC(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCC(C)C)Cl

InChI

InChI=1S/C12H17ClN2S/c1-8(2)7-14-12(16)15-10-5-4-9(3)11(13)6-10/h4-6,8H,7H2,1-3H3,(H2,14,15,16)