3-(4-azanylbutyl)-2-dibenzothiophen-2-yl-1H-indole-5-carbonitrile

Systemtic Name: 3-(4-azanylbutyl)-2-dibenzothiophen-2-yl-1H-indole-5-carbonitrile Openeye Name: 3-(4-aminobutyl)-2-dibenzothiophen-2-yl-1H-indole-5-carbonitrile CAS Name: 3-(4-aminobutyl)-2-(2-dibenzothiophenyl)-1H-indole-5-carbonitrile IUPAC Name: 3-(4-aminobutyl)-2-dibenzothiophen-2-yl-1H-indole-5-carbonitrile Traditional Name: 3-(4-aminobutyl)-2-dibenzothiophen-2-yl-1H-indole-5-carbonitrile Formula: C25H21N3S MolecularWeight: 395.51934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(S2)C=CC(=C3)C4=C(C5=C(N4)C=CC(=C5)C#N)CCCCN

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(S2)C=CC(=C3)C4=C(C5=C(N4)C=CC(=C5)C#N)CCCCN

InChI

InChI=1S/C25H21N3S/c26-12-4-3-6-19-20-13-16(15-27)8-10-22(20)28-25(19)17-9-11-24-21(14-17)18-5-1-2-7-23(18)29-24/h1-2,5,7-11,13-14,28H,3-4,6,12,26H2