1-[N-(4,6-dimethylpyrimidin-2-yl)-N'-phenethyl-carbamimidoyl]-3-(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 1-[N-(4,6-dimethylpyrimidin-2-yl)-N'-phenethyl-carbamimidoyl]-3-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 1-[N-(4,6-dimethylpyrimidin-2-yl)-N'-phenethyl-carbamimidoyl]-3-(3-morpholinopropyl)thiourea CAS Name: 1-[[(4,6-dimethyl-2-pyrimidinyl)amino]-phenethyliminomethyl]-3-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 1-[N-(4,6-dimethylpyrimidin-2-yl)-N'-phenethylcarbamimidoyl]-3-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 1-[N-(4,6-dimethylpyrimidin-2-yl)-N'-phenethyl-amidino]-3-(3-morpholinopropyl)thiourea Formula: C23H33N7OS MolecularWeight: 455.61942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=NCCC2=CC=CC=C2)NC(=S)NCCCN3CCOCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=NCCC2=CC=CC=C2)NC(=S)NCCCN3CCOCC3)C

InChI

InChI=1S/C23H33N7OS/c1-18-17-19(2)27-22(26-18)28-21(24-11-9-20-7-4-3-5-8-20)29-23(32)25-10-6-12-30-13-15-31-16-14-30/h3-5,7-8,17H,6,9-16H2,1-2H3,(H3,24,25,26,27,28,29,32)