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

Systemtic Name: 1-carbamimidoyl-3-(phenylmethyl)-1-(2-pyridin-3-ylethyl)thiourea Openeye Name: 3-benzyl-1-carbamimidoyl-1-[2-(3-pyridyl)ethyl]thiourea CAS Name: 1-carbamimidoyl-3-(phenylmethyl)-1-[2-(3-pyridinyl)ethyl]thiourea IUPAC Name: 3-benzyl-1-carbamimidoyl-1-(2-pyridin-3-ylethyl)thiourea Traditional Name: 1-amidino-3-benzyl-1-[2-(3-pyridyl)ethyl]thiourea Formula: C16H19N5S MolecularWeight: 313.42056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)N(CCC2=CN=CC=C2)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)N(CCC2=CN=CC=C2)C(=N)N

InChI

InChI=1S/C16H19N5S/c17-15(18)21(10-8-14-7-4-9-19-11-14)16(22)20-12-13-5-2-1-3-6-13/h1-7,9,11H,8,10,12H2,(H3,17,18)(H,20,22)