3-(2-phenyl-1,3-benzodithiol-2-yl)-1H-pyrrole

Systemtic Name: 3-(2-phenyl-1,3-benzodithiol-2-yl)-1H-pyrrole Openeye Name: 3-(2-phenyl-1,3-benzodithiol-2-yl)-1H-pyrrole CAS Name: 3-(2-phenyl-1,3-benzodithiol-2-yl)-1H-pyrrole IUPAC Name: 3-(2-phenyl-1,3-benzodithiol-2-yl)-1H-pyrrole Traditional Name: 3-(2-phenyl-1,3-benzodithiol-2-yl)-1H-pyrrole Formula: C17H13NS2 MolecularWeight: 295.42182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(SC3=CC=CC=C3S2)C4=CNC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2(SC3=CC=CC=C3S2)C4=CNC=C4

InChI

InChI=1S/C17H13NS2/c1-2-6-13(7-3-1)17(14-10-11-18-12-14)19-15-8-4-5-9-16(15)20-17/h1-12,18H