2-[[3-(2-azanylethyl)-1H-indol-5-yl]oxy]-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanethione

Systemtic Name: 2-[[3-(2-azanylethyl)-1H-indol-5-yl]oxy]-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanethione Openeye Name: 2-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanethione CAS Name: 2-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-1-[4-(4-nitrophenyl)-1-piperazinyl]ethanethione IUPAC Name: 2-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanethione Traditional Name: 2-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-1-[4-(4-nitrophenyl)piperazino]ethanethione Formula: C22H25N5O3S MolecularWeight: 439.5306

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=S)COC3=CC4=C(C=C3)NC=C4CCN

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=S)COC3=CC4=C(C=C3)NC=C4CCN

InChI

InChI=1S/C22H25N5O3S/c23-8-7-16-14-24-21-6-5-19(13-20(16)21)30-15-22(31)26-11-9-25(10-12-26)17-1-3-18(4-2-17)27(28)29/h1-6,13-14,24H,7-12,15,23H2