1-carbamimidoyl-1-[3-(3-chloranylpyridin-2-yl)propyl]-3-(2-methoxyethyl)thiourea

Systemtic Name: 1-carbamimidoyl-1-[3-(3-chloranylpyridin-2-yl)propyl]-3-(2-methoxyethyl)thiourea Openeye Name: 1-carbamimidoyl-1-[3-(3-chloro-2-pyridyl)propyl]-3-(2-methoxyethyl)thiourea CAS Name: 1-carbamimidoyl-1-[3-(3-chloro-2-pyridinyl)propyl]-3-(2-methoxyethyl)thiourea IUPAC Name: 1-carbamimidoyl-1-[3-(3-chloropyridin-2-yl)propyl]-3-(2-methoxyethyl)thiourea Traditional Name: 1-amidino-1-[3-(3-chloro-2-pyridyl)propyl]-3-(2-methoxyethyl)thiourea Formula: C13H20ClN5OS MolecularWeight: 329.8488

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)N(CCCC1=C(C=CC=N1)Cl)C(=N)N

Isomeric SMILES

COCCNC(=S)N(CCCC1=C(C=CC=N1)Cl)C(=N)N

InChI

InChI=1S/C13H20ClN5OS/c1-20-9-7-18-13(21)19(12(15)16)8-3-5-11-10(14)4-2-6-17-11/h2,4,6H,3,5,7-9H2,1H3,(H3,15,16)(H,18,21)