1-(4-cyclohexylcarbonyl-1,4-diazepan-1-yl)-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanone

Systemtic Name: 1-(4-cyclohexylcarbonyl-1,4-diazepan-1-yl)-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanone Openeye Name: 1-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanone CAS Name: 1-[4-[cyclohexyl(oxo)methyl]-1,4-diazepan-1-yl]-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanone IUPAC Name: 1-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanone Traditional Name: 1-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanone Formula: C27H35N3O2S MolecularWeight: 465.6507

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CCCN(CC2)C(=O)CN3CCC4=C(C3C5=CC=CC=C5)C=CS4

Isomeric SMILES

C1CCC(CC1)C(=O)N2CCCN(CC2)C(=O)CN3CCC4=C(C3C5=CC=CC=C5)C=CS4

InChI

InChI=1S/C27H35N3O2S/c31-25(28-14-7-15-29(18-17-28)27(32)22-10-5-2-6-11-22)20-30-16-12-24-23(13-19-33-24)26(30)21-8-3-1-4-9-21/h1,3-4,8-9,13,19,22,26H,2,5-7,10-12,14-18,20H2