3-tert-butyl-1-[(6-chloranylpyridin-3-yl)methyl]-1-methyl-thiourea

Systemtic Name: 3-tert-butyl-1-[(6-chloranylpyridin-3-yl)methyl]-1-methyl-thiourea Openeye Name: 3-tert-butyl-1-[(6-chloro-3-pyridyl)methyl]-1-methyl-thiourea CAS Name: 3-tert-butyl-1-[(6-chloro-3-pyridinyl)methyl]-1-methylthiourea IUPAC Name: 3-tert-butyl-1-[(6-chloropyridin-3-yl)methyl]-1-methylthiourea Traditional Name: 3-tert-butyl-1-[(6-chloro-3-pyridyl)methyl]-1-methyl-thiourea Formula: C12H18ClN3S MolecularWeight: 271.80942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18ClN3S/c1-12(2,3)15-11(17)16(4)8-9-5-6-10(13)14-7-9/h5-7H,8H2,1-4H3,(H,15,17)