1-(3-chloranyl-2-methyl-phenyl)-3-(6-methylheptan-2-yl)thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-(6-methylheptan-2-yl)thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-(1,5-dimethylhexyl)thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-(6-methylheptan-2-yl)thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-(6-methylheptan-2-yl)thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-(1,5-dimethylhexyl)thiourea Formula: C16H25ClN2S MolecularWeight: 312.9011

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NC(C)CCCC(C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NC(C)CCCC(C)C

InChI

InChI=1S/C16H25ClN2S/c1-11(2)7-5-8-12(3)18-16(20)19-15-10-6-9-14(17)13(15)4/h6,9-12H,5,7-8H2,1-4H3,(H2,18,19,20)