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

Systemtic Name: 3-butyl-1-carbamimidoyl-1-[2-(3-chloranylpyridin-2-yl)ethyl]thiourea Openeye Name: 3-butyl-1-carbamimidoyl-1-[2-(3-chloro-2-pyridyl)ethyl]thiourea CAS Name: 3-butyl-1-carbamimidoyl-1-[2-(3-chloro-2-pyridinyl)ethyl]thiourea IUPAC Name: 3-butyl-1-carbamimidoyl-1-[2-(3-chloropyridin-2-yl)ethyl]thiourea Traditional Name: 1-amidino-3-butyl-1-[2-(3-chloro-2-pyridyl)ethyl]thiourea Formula: C13H20ClN5S MolecularWeight: 313.8494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(CCC1=C(C=CC=N1)Cl)C(=N)N

Isomeric SMILES

CCCCNC(=S)N(CCC1=C(C=CC=N1)Cl)C(=N)N

InChI

InChI=1S/C13H20ClN5S/c1-2-3-7-18-13(20)19(12(15)16)9-6-11-10(14)5-4-8-17-11/h4-5,8H,2-3,6-7,9H2,1H3,(H3,15,16)(H,18,20)