4-(2-dibenzothiophen-2-yl-1H-benzo[g]indol-3-yl)butan-1-amine

Systemtic Name: 4-(2-dibenzothiophen-2-yl-1H-benzo[g]indol-3-yl)butan-1-amine Openeye Name: 4-(2-dibenzothiophen-2-yl-1H-benzo[g]indol-3-yl)butan-1-amine CAS Name: 4-[2-(2-dibenzothiophenyl)-1H-benzo[g]indol-3-yl]-1-butanamine IUPAC Name: 4-(2-dibenzothiophen-2-yl-1H-benzo[g]indol-3-yl)butan-1-amine Traditional Name: 4-(2-dibenzothiophen-2-yl-1H-benz[g]indol-3-yl)butylamine Formula: C28H24N2S MolecularWeight: 420.56856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2NC(=C3CCCCN)C4=CC5=C(C=C4)SC6=CC=CC=C65

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2NC(=C3CCCCN)C4=CC5=C(C=C4)SC6=CC=CC=C65

InChI

InChI=1S/C28H24N2S/c29-16-6-5-10-22-23-14-12-18-7-1-2-8-20(18)28(23)30-27(22)19-13-15-26-24(17-19)21-9-3-4-11-25(21)31-26/h1-4,7-9,11-15,17,30H,5-6,10,16,29H2