1-carbamimidoyl-3-prop-2-ynyl-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 1-carbamimidoyl-3-prop-2-ynyl-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 1-carbamimidoyl-3-prop-2-ynyl-1-(4-pyridylmethyl)thiourea CAS Name: 1-carbamimidoyl-3-prop-2-ynyl-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 1-carbamimidoyl-3-prop-2-ynyl-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-amidino-3-propargyl-1-(4-pyridylmethyl)thiourea Formula: C11H13N5S MolecularWeight: 247.31942

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=S)N(CC1=CC=NC=C1)C(=N)N

Isomeric SMILES

C#CCNC(=S)N(CC1=CC=NC=C1)C(=N)N

InChI

InChI=1S/C11H13N5S/c1-2-5-15-11(17)16(10(12)13)8-9-3-6-14-7-4-9/h1,3-4,6-7H,5,8H2,(H3,12,13)(H,15,17)