1-carbamimidoyl-1-[3-(3-methylpyridin-2-yl)propyl]-3-(2-phenylmethoxyethyl)thiourea

Systemtic Name: 1-carbamimidoyl-1-[3-(3-methylpyridin-2-yl)propyl]-3-(2-phenylmethoxyethyl)thiourea Openeye Name: 3-(2-benzyloxyethyl)-1-carbamimidoyl-1-[3-(3-methyl-2-pyridyl)propyl]thiourea CAS Name: 1-carbamimidoyl-1-[3-(3-methyl-2-pyridinyl)propyl]-3-(2-phenylmethoxyethyl)thiourea IUPAC Name: 1-carbamimidoyl-1-[3-(3-methylpyridin-2-yl)propyl]-3-(2-phenylmethoxyethyl)thiourea Traditional Name: 1-amidino-3-(2-benzoxyethyl)-1-[3-(3-methyl-2-pyridyl)propyl]thiourea Formula: C20H27N5OS MolecularWeight: 385.52628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)CCCN(C(=N)N)C(=S)NCCOCC2=CC=CC=C2

Isomeric SMILES

CC1=C(N=CC=C1)CCCN(C(=N)N)C(=S)NCCOCC2=CC=CC=C2

InChI

InChI=1S/C20H27N5OS/c1-16-7-5-11-23-18(16)10-6-13-25(19(21)22)20(27)24-12-14-26-15-17-8-3-2-4-9-17/h2-5,7-9,11H,6,10,12-15H2,1H3,(H3,21,22)(H,24,27)