4-(2-cyclohexyl-1,3-benzodithiol-2-yl)-2-(2-cyclohexyl-1,3-benzoxathiol-2-yl)-1H-pyrrole

Systemtic Name: 4-(2-cyclohexyl-1,3-benzodithiol-2-yl)-2-(2-cyclohexyl-1,3-benzoxathiol-2-yl)-1H-pyrrole Openeye Name: 4-(2-cyclohexyl-1,3-benzodithiol-2-yl)-2-(2-cyclohexyl-1,3-benzoxathiol-2-yl)-1H-pyrrole CAS Name: 4-(2-cyclohexyl-1,3-benzodithiol-2-yl)-2-(2-cyclohexyl-1,3-benzoxathiol-2-yl)-1H-pyrrole IUPAC Name: 4-(2-cyclohexyl-1,3-benzodithiol-2-yl)-2-(2-cyclohexyl-1,3-benzoxathiol-2-yl)-1H-pyrrole Traditional Name: 4-(2-cyclohexyl-1,3-benzodithiol-2-yl)-2-(2-cyclohexyl-1,3-benzoxathiol-2-yl)-1H-pyrrole Formula: C30H33NOS3 MolecularWeight: 519.78412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2(OC3=CC=CC=C3S2)C4=CC(=CN4)C5(SC6=CC=CC=C6S5)C7CCCCC7

Isomeric SMILES

C1CCC(CC1)C2(OC3=CC=CC=C3S2)C4=CC(=CN4)C5(SC6=CC=CC=C6S5)C7CCCCC7

InChI

InChI=1S/C30H33NOS3/c1-3-11-21(12-4-1)29(32-24-15-7-8-16-25(24)33-29)28-19-23(20-31-28)30(22-13-5-2-6-14-22)34-26-17-9-10-18-27(26)35-30/h7-10,15-22,31H,1-6,11-14H2