3-tert-butylsulfanyl-2-[(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)amino]-N-(3-phenylpropyl)propanamide

Systemtic Name: 3-tert-butylsulfanyl-2-[(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)amino]-N-(3-phenylpropyl)propanamide Openeye Name: 3-tert-butylsulfanyl-2-[(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)amino]-N-(3-phenylpropyl)propanamide CAS Name: 3-(tert-butylthio)-2-[[6-chloro-2-(1-imidazolyl)-4-pyrimidinyl]amino]-N-(3-phenylpropyl)propanamide IUPAC Name: 3-tert-butylsulfanyl-2-[(6-chloro-2-imidazol-1-ylpyrimidin-4-yl)amino]-N-(3-phenylpropyl)propanamide Traditional Name: 3-(tert-butylthio)-2-[(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)amino]-N-(3-phenylpropyl)propionamide Formula: C23H29ClN6OS MolecularWeight: 473.03396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(C(=O)NCCCC1=CC=CC=C1)NC2=CC(=NC(=N2)N3C=CN=C3)Cl

Isomeric SMILES

CC(C)(C)SCC(C(=O)NCCCC1=CC=CC=C1)NC2=CC(=NC(=N2)N3C=CN=C3)Cl

InChI

InChI=1S/C23H29ClN6OS/c1-23(2,3)32-15-18(21(31)26-11-7-10-17-8-5-4-6-9-17)27-20-14-19(24)28-22(29-20)30-13-12-25-16-30/h4-6,8-9,12-14,16,18H,7,10-11,15H2,1-3H3,(H,26,31)(H,27,28,29)