2-[(7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl)sulfanyl]-1-piperidin-1-yl-propan-1-one

Systemtic Name: 2-[(7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl)sulfanyl]-1-piperidin-1-yl-propan-1-one Openeye Name: 2-[(7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl)sulfanyl]-1-(1-piperidyl)propan-1-one CAS Name: 2-[(7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl)thio]-1-(1-piperidinyl)-1-propanone IUPAC Name: 2-[(7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl)sulfanyl]-1-piperidin-1-ylpropan-1-one Traditional Name: 2-[(7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl)thio]-1-piperidino-propan-1-one Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1)SC2=NC(=NC3=C2COC(C3)(C)C)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)N1CCCCC1)SC2=NC(=NC3=C2COC(C3)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C23H29N3O2S/c1-16(22(27)26-12-8-5-9-13-26)29-21-18-15-28-23(2,3)14-19(18)24-20(25-21)17-10-6-4-7-11-17/h4,6-7,10-11,16H,5,8-9,12-15H2,1-3H3