1-carbamimidoyl-1-[3-(3-methylpyridin-2-yl)propyl]-3-pentyl-thiourea

Systemtic Name: 1-carbamimidoyl-1-[3-(3-methylpyridin-2-yl)propyl]-3-pentyl-thiourea Openeye Name: 1-carbamimidoyl-1-[3-(3-methyl-2-pyridyl)propyl]-3-pentyl-thiourea CAS Name: 1-carbamimidoyl-1-[3-(3-methyl-2-pyridinyl)propyl]-3-pentylthiourea IUPAC Name: 1-carbamimidoyl-1-[3-(3-methylpyridin-2-yl)propyl]-3-pentylthiourea Traditional Name: 1-amidino-3-amyl-1-[3-(3-methyl-2-pyridyl)propyl]thiourea Formula: C16H27N5S MolecularWeight: 321.48408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)N(CCCC1=C(C=CC=N1)C)C(=N)N

Isomeric SMILES

CCCCCNC(=S)N(CCCC1=C(C=CC=N1)C)C(=N)N

InChI

InChI=1S/C16H27N5S/c1-3-4-5-10-20-16(22)21(15(17)18)12-7-9-14-13(2)8-6-11-19-14/h6,8,11H,3-5,7,9-10,12H2,1-2H3,(H3,17,18)(H,20,22)