1-carbamimidoyl-3-prop-2-ynyl-1-(2-pyridin-3-ylethyl)thiourea

Systemtic Name: 1-carbamimidoyl-3-prop-2-ynyl-1-(2-pyridin-3-ylethyl)thiourea Openeye Name: 1-carbamimidoyl-3-prop-2-ynyl-1-[2-(3-pyridyl)ethyl]thiourea CAS Name: 1-carbamimidoyl-3-prop-2-ynyl-1-[2-(3-pyridinyl)ethyl]thiourea IUPAC Name: 1-carbamimidoyl-3-prop-2-ynyl-1-(2-pyridin-3-ylethyl)thiourea Traditional Name: 1-amidino-3-propargyl-1-[2-(3-pyridyl)ethyl]thiourea Formula: C12H15N5S MolecularWeight: 261.346

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=S)N(CCC1=CN=CC=C1)C(=N)N

Isomeric SMILES

C#CCNC(=S)N(CCC1=CN=CC=C1)C(=N)N

InChI

InChI=1S/C12H15N5S/c1-2-6-16-12(18)17(11(13)14)8-5-10-4-3-7-15-9-10/h1,3-4,7,9H,5-6,8H2,(H3,13,14)(H,16,18)