1-carbamimidoyl-3-prop-2-enyl-1-(2-pyridin-4-ylethyl)thiourea

Systemtic Name: 1-carbamimidoyl-3-prop-2-enyl-1-(2-pyridin-4-ylethyl)thiourea Openeye Name: 3-allyl-1-carbamimidoyl-1-[2-(4-pyridyl)ethyl]thiourea CAS Name: 1-carbamimidoyl-3-prop-2-enyl-1-(2-pyridin-4-ylethyl)thiourea IUPAC Name: 1-carbamimidoyl-3-prop-2-enyl-1-(2-pyridin-4-ylethyl)thiourea Traditional Name: 3-allyl-1-amidino-1-[2-(4-pyridyl)ethyl]thiourea Formula: C12H17N5S MolecularWeight: 263.36188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)N(CCC1=CC=NC=C1)C(=N)N

Isomeric SMILES

C=CCNC(=S)N(CCC1=CC=NC=C1)C(=N)N

InChI

InChI=1S/C12H17N5S/c1-2-6-16-12(18)17(11(13)14)9-5-10-3-7-15-8-4-10/h2-4,7-8H,1,5-6,9H2,(H3,13,14)(H,16,18)