1-(2-chloranyl-4,6-dimethyl-phenyl)-3-[(1R)-1-pyridin-3-ylethyl]thiourea

Systemtic Name: 1-(2-chloranyl-4,6-dimethyl-phenyl)-3-[(1R)-1-pyridin-3-ylethyl]thiourea Openeye Name: 1-(2-chloro-4,6-dimethyl-phenyl)-3-[(1R)-1-(3-pyridyl)ethyl]thiourea CAS Name: 1-(2-chloro-4,6-dimethylphenyl)-3-[(1R)-1-(3-pyridinyl)ethyl]thiourea IUPAC Name: 1-(2-chloro-4,6-dimethylphenyl)-3-[(1R)-1-pyridin-3-ylethyl]thiourea Traditional Name: 1-(2-chloro-4,6-dimethyl-phenyl)-3-[(1R)-1-(3-pyridyl)ethyl]thiourea Formula: C16H18ClN3S MolecularWeight: 319.85222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=S)NC(C)C2=CN=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=S)N[C@H](C)C2=CN=CC=C2)C

InChI

InChI=1S/C16H18ClN3S/c1-10-7-11(2)15(14(17)8-10)20-16(21)19-12(3)13-5-4-6-18-9-13/h4-9,12H,1-3H3,(H2,19,20,21)/t12-/m1/s1