4-(5-cyano-3,3-dimethyl-8-propan-2-yl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)-N-phenyl-piperazine-1-carbothioamide

Systemtic Name: 4-(5-cyano-3,3-dimethyl-8-propan-2-yl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)-N-phenyl-piperazine-1-carbothioamide Openeye Name: 4-(5-cyano-8-isopropyl-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)-N-phenyl-piperazine-1-carbothioamide CAS Name: 4-(5-cyano-3,3-dimethyl-8-propan-2-yl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)-N-phenyl-1-piperazinecarbothioamide IUPAC Name: 4-(5-cyano-3,3-dimethyl-8-propan-2-yl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide Traditional Name: 4-(5-cyano-8-isopropyl-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)-N-phenyl-piperazine-1-carbothioamide Formula: C25H31N5OS MolecularWeight: 449.61154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2COC(CC2=C(C(=N1)N3CCN(CC3)C(=S)NC4=CC=CC=C4)C#N)(C)C

Isomeric SMILES

CC(C)C1=C2COC(CC2=C(C(=N1)N3CCN(CC3)C(=S)NC4=CC=CC=C4)C#N)(C)C

InChI

InChI=1S/C25H31N5OS/c1-17(2)22-21-16-31-25(3,4)14-19(21)20(15-26)23(28-22)29-10-12-30(13-11-29)24(32)27-18-8-6-5-7-9-18/h5-9,17H,10-14,16H2,1-4H3,(H,27,32)