cyclohexyl-[5-(2-cyclohexyl-1,3-benzodithiol-2-yl)-1H-pyrrol-3-yl]methanone

Systemtic Name: cyclohexyl-[5-(2-cyclohexyl-1,3-benzodithiol-2-yl)-1H-pyrrol-3-yl]methanone Openeye Name: cyclohexyl-[5-(2-cyclohexyl-1,3-benzodithiol-2-yl)-1H-pyrrol-3-yl]methanone CAS Name: cyclohexyl-[5-(2-cyclohexyl-1,3-benzodithiol-2-yl)-1H-pyrrol-3-yl]methanone IUPAC Name: cyclohexyl-[5-(2-cyclohexyl-1,3-benzodithiol-2-yl)-1H-pyrrol-3-yl]methanone Traditional Name: cyclohexyl-[5-(2-cyclohexyl-1,3-benzodithiol-2-yl)-1H-pyrrol-3-yl]methanone Formula: C24H29NOS2 MolecularWeight: 411.62316

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)C2=CNC(=C2)C3(SC4=CC=CC=C4S3)C5CCCCC5

Isomeric SMILES

C1CCC(CC1)C(=O)C2=CNC(=C2)C3(SC4=CC=CC=C4S3)C5CCCCC5

InChI

InChI=1S/C24H29NOS2/c26-23(17-9-3-1-4-10-17)18-15-22(25-16-18)24(19-11-5-2-6-12-19)27-20-13-7-8-14-21(20)28-24/h7-8,13-17,19,25H,1-6,9-12H2