4-[4-(1-benzothiophen-7-yl)-2,3-dihydropyrrol-1-yl]-1-cyclohexyl-2-methyl-2-phenyl-butan-1-one

Systemtic Name: 4-[4-(1-benzothiophen-7-yl)-2,3-dihydropyrrol-1-yl]-1-cyclohexyl-2-methyl-2-phenyl-butan-1-one Openeye Name: 4-[4-(benzothiophen-7-yl)-2,3-dihydropyrrol-1-yl]-1-cyclohexyl-2-methyl-2-phenyl-butan-1-one CAS Name: 4-[4-(1-benzothiophen-7-yl)-2,3-dihydropyrrol-1-yl]-1-cyclohexyl-2-methyl-2-phenyl-1-butanone IUPAC Name: 4-[4-(1-benzothiophen-7-yl)-2,3-dihydropyrrol-1-yl]-1-cyclohexyl-2-methyl-2-phenylbutan-1-one Traditional Name: 4-[3-(benzothiophen-7-yl)-2-pyrrolin-1-yl]-1-cyclohexyl-2-methyl-2-phenyl-butan-1-one Formula: C29H33NOS MolecularWeight: 443.64342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1CCC(=C1)C2=CC=CC3=C2SC=C3)(C4=CC=CC=C4)C(=O)C5CCCCC5

Isomeric SMILES

CC(CCN1CCC(=C1)C2=CC=CC3=C2SC=C3)(C4=CC=CC=C4)C(=O)C5CCCCC5

InChI

InChI=1S/C29H33NOS/c1-29(25-12-6-3-7-13-25,28(31)23-9-4-2-5-10-23)17-19-30-18-15-24(21-30)26-14-8-11-22-16-20-32-27(22)26/h3,6-8,11-14,16,20-21,23H,2,4-5,9-10,15,17-19H2,1H3