3-tert-butyl-1-carbamimidoyl-1-[(3-chloranylpyridin-2-yl)methyl]thiourea

Systemtic Name: 3-tert-butyl-1-carbamimidoyl-1-[(3-chloranylpyridin-2-yl)methyl]thiourea Openeye Name: 3-tert-butyl-1-carbamimidoyl-1-[(3-chloro-2-pyridyl)methyl]thiourea CAS Name: 3-tert-butyl-1-carbamimidoyl-1-[(3-chloro-2-pyridinyl)methyl]thiourea IUPAC Name: 3-tert-butyl-1-carbamimidoyl-1-[(3-chloropyridin-2-yl)methyl]thiourea Traditional Name: 1-amidino-3-tert-butyl-1-[(3-chloro-2-pyridyl)methyl]thiourea Formula: C12H18ClN5S MolecularWeight: 299.82282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)N(CC1=C(C=CC=N1)Cl)C(=N)N

Isomeric SMILES

CC(C)(C)NC(=S)N(CC1=C(C=CC=N1)Cl)C(=N)N

InChI

InChI=1S/C12H18ClN5S/c1-12(2,3)17-11(19)18(10(14)15)7-9-8(13)5-4-6-16-9/h4-6H,7H2,1-3H3,(H3,14,15)(H,17,19)