1-carbamimidoyl-1-[2-(3-chloranylpyridin-2-yl)ethyl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-carbamimidoyl-1-[2-(3-chloranylpyridin-2-yl)ethyl]-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-carbamimidoyl-1-[2-(3-chloro-2-pyridyl)ethyl]thiourea CAS Name: 1-carbamimidoyl-1-[2-(3-chloro-2-pyridinyl)ethyl]-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-carbamimidoyl-1-[2-(3-chloropyridin-2-yl)ethyl]thiourea Traditional Name: 1-amidino-3-benzyl-1-[2-(3-chloro-2-pyridyl)ethyl]thiourea Formula: C16H18ClN5S MolecularWeight: 347.86562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)N(CCC2=C(C=CC=N2)Cl)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)N(CCC2=C(C=CC=N2)Cl)C(=N)N

InChI

InChI=1S/C16H18ClN5S/c17-13-7-4-9-20-14(13)8-10-22(15(18)19)16(23)21-11-12-5-2-1-3-6-12/h1-7,9H,8,10-11H2,(H3,18,19)(H,21,23)