[4-[3-(azepan-1-yl)propoxy]phenyl]-(2-cyclohexyl-6-oxidanyl-1-benzothiophen-3-yl)methanone

Systemtic Name: [4-[3-(azepan-1-yl)propoxy]phenyl]-(2-cyclohexyl-6-oxidanyl-1-benzothiophen-3-yl)methanone Openeye Name: [4-[3-(azepan-1-yl)propoxy]phenyl]-(2-cyclohexyl-6-hydroxy-benzothiophen-3-yl)methanone CAS Name: [4-[3-(1-azepanyl)propoxy]phenyl]-(2-cyclohexyl-6-hydroxy-1-benzothiophen-3-yl)methanone IUPAC Name: [4-[3-(azepan-1-yl)propoxy]phenyl]-(2-cyclohexyl-6-hydroxy-1-benzothiophen-3-yl)methanone Traditional Name: [4-[3-(azepan-1-yl)propoxy]phenyl]-(2-cyclohexyl-6-hydroxy-benzothiophen-3-yl)methanone Formula: C30H37NO3S MolecularWeight: 491.68468

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5CCCCC5

Isomeric SMILES

C1CCCN(CC1)CCCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5CCCCC5

InChI

InChI=1S/C30H37NO3S/c32-24-13-16-26-27(21-24)35-30(23-9-4-3-5-10-23)28(26)29(33)22-11-14-25(15-12-22)34-20-8-19-31-17-6-1-2-7-18-31/h11-16,21,23,32H,1-10,17-20H2