3-(3-chloranyl-2-methyl-phenyl)-1,1-dihexyl-thiourea

Systemtic Name: 3-(3-chloranyl-2-methyl-phenyl)-1,1-dihexyl-thiourea Openeye Name: 3-(3-chloro-2-methyl-phenyl)-1,1-dihexyl-thiourea CAS Name: 3-(3-chloro-2-methylphenyl)-1,1-dihexylthiourea IUPAC Name: 3-(3-chloro-2-methylphenyl)-1,1-dihexylthiourea Traditional Name: 3-(3-chloro-2-methyl-phenyl)-1,1-dihexyl-thiourea Formula: C20H33ClN2S MolecularWeight: 369.00742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C(=S)NC1=C(C(=CC=C1)Cl)C

Isomeric SMILES

CCCCCCN(CCCCCC)C(=S)NC1=C(C(=CC=C1)Cl)C

InChI

InChI=1S/C20H33ClN2S/c1-4-6-8-10-15-23(16-11-9-7-5-2)20(24)22-19-14-12-13-18(21)17(19)3/h12-14H,4-11,15-16H2,1-3H3,(H,22,24)