4-(5-cyano-3,3-dimethyl-8-propan-2-yl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)-N-(phenylmethyl)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-(phenylmethyl)piperazine-1-carbothioamide Openeye Name: N-benzyl-4-(5-cyano-8-isopropyl-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)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-(phenylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-benzyl-4-(5-cyano-3,3-dimethyl-8-propan-2-yl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)piperazine-1-carbothioamide Traditional Name: N-benzyl-4-(5-cyano-8-isopropyl-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)piperazine-1-carbothioamide Formula: C26H33N5OS MolecularWeight: 463.63812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2COC(CC2=C(C(=N1)N3CCN(CC3)C(=S)NCC4=CC=CC=C4)C#N)(C)C

Isomeric SMILES

CC(C)C1=C2COC(CC2=C(C(=N1)N3CCN(CC3)C(=S)NCC4=CC=CC=C4)C#N)(C)C

InChI

InChI=1S/C26H33N5OS/c1-18(2)23-22-17-32-26(3,4)14-20(22)21(15-27)24(29-23)30-10-12-31(13-11-30)25(33)28-16-19-8-6-5-7-9-19/h5-9,18H,10-14,16-17H2,1-4H3,(H,28,33)