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

Systemtic Name: 1-carbamimidoyl-3-(phenylmethyl)-1-(3-pyridin-3-ylpropyl)thiourea Openeye Name: 3-benzyl-1-carbamimidoyl-1-[3-(3-pyridyl)propyl]thiourea CAS Name: 1-carbamimidoyl-3-(phenylmethyl)-1-[3-(3-pyridinyl)propyl]thiourea IUPAC Name: 3-benzyl-1-carbamimidoyl-1-(3-pyridin-3-ylpropyl)thiourea Traditional Name: 1-amidino-3-benzyl-1-[3-(3-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=CN=CC=C2)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)N(CCCC2=CN=CC=C2)C(=N)N

InChI

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