4-[4-[(2-cyclohexyl-6-methoxy-1-benzothiophen-3-yl)carbonyl]phenyl]-1-pyrrolidin-1-yl-butan-1-one

Systemtic Name: 4-[4-[(2-cyclohexyl-6-methoxy-1-benzothiophen-3-yl)carbonyl]phenyl]-1-pyrrolidin-1-yl-butan-1-one Openeye Name: 4-[4-(2-cyclohexyl-6-methoxy-benzothiophene-3-carbonyl)phenyl]-1-pyrrolidin-1-yl-butan-1-one CAS Name: 4-[4-[(2-cyclohexyl-6-methoxy-1-benzothiophen-3-yl)-oxomethyl]phenyl]-1-(1-pyrrolidinyl)-1-butanone IUPAC Name: 4-[4-(2-cyclohexyl-6-methoxy-1-benzothiophene-3-carbonyl)phenyl]-1-pyrrolidin-1-ylbutan-1-one Traditional Name: 4-[4-(2-cyclohexyl-6-methoxy-benzothiophene-3-carbonyl)phenyl]-1-pyrrolidino-butan-1-one Formula: C30H35NO3S MolecularWeight: 489.6688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C3CCCCC3)C(=O)C4=CC=C(C=C4)CCCC(=O)N5CCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C3CCCCC3)C(=O)C4=CC=C(C=C4)CCCC(=O)N5CCCC5

InChI

InChI=1S/C30H35NO3S/c1-34-24-16-17-25-26(20-24)35-30(23-9-3-2-4-10-23)28(25)29(33)22-14-12-21(13-15-22)8-7-11-27(32)31-18-5-6-19-31/h12-17,20,23H,2-11,18-19H2,1H3