2-[[cyclopropyl-[(4-methylphenyl)methyl]amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[cyclopropyl-[(4-methylphenyl)methyl]amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[[cyclopropyl(p-tolylmethyl)amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[cyclopropyl-[(4-methylphenyl)methyl]amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[cyclopropyl-[(4-methylphenyl)methyl]amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[cyclopropyl-(4-methylbenzyl)amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC2=NC(=O)C3=C(N2)C=CS3)C4CC4

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC2=NC(=O)C3=C(N2)C=CS3)C4CC4

InChI

InChI=1S/C18H19N3OS/c1-12-2-4-13(5-3-12)10-21(14-6-7-14)11-16-19-15-8-9-23-17(15)18(22)20-16/h2-5,8-9,14H,6-7,10-11H2,1H3,(H,19,20,22)