1-carbamimidoyl-3-(phenylmethyl)-1-(3-pyridin-2-ylpropyl)thiourea

Systemtic Name: 1-carbamimidoyl-3-(phenylmethyl)-1-(3-pyridin-2-ylpropyl)thiourea Openeye Name: 3-benzyl-1-carbamimidoyl-1-[3-(2-pyridyl)propyl]thiourea CAS Name: 1-carbamimidoyl-3-(phenylmethyl)-1-[3-(2-pyridinyl)propyl]thiourea IUPAC Name: 3-benzyl-1-carbamimidoyl-1-(3-pyridin-2-ylpropyl)thiourea Traditional Name: 1-amidino-3-benzyl-1-[3-(2-pyridyl)propyl]thiourea Formula: C17H21N5S MolecularWeight: 327.44714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)N(CCCC2=CC=CC=N2)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)N(CCCC2=CC=CC=N2)C(=N)N

InChI

InChI=1S/C17H21N5S/c18-16(19)22(12-6-10-15-9-4-5-11-20-15)17(23)21-13-14-7-2-1-3-8-14/h1-5,7-9,11H,6,10,12-13H2,(H3,18,19)(H,21,23)