1-[4-(1H-indol-4-yl)piperazin-1-yl]-1-(5-nitro-1-benzothiophen-3-yl)propan-1-ol

Systemtic Name: 1-[4-(1H-indol-4-yl)piperazin-1-yl]-1-(5-nitro-1-benzothiophen-3-yl)propan-1-ol Openeye Name: 1-[4-(1H-indol-4-yl)piperazin-1-yl]-1-(5-nitrobenzothiophen-3-yl)propan-1-ol CAS Name: 1-[4-(1H-indol-4-yl)-1-piperazinyl]-1-(5-nitro-1-benzothiophen-3-yl)-1-propanol IUPAC Name: 1-[4-(1H-indol-4-yl)piperazin-1-yl]-1-(5-nitro-1-benzothiophen-3-yl)propan-1-ol Traditional Name: 1-[4-(1H-indol-4-yl)piperazino]-1-(5-nitrobenzothiophen-3-yl)propan-1-ol Formula: C23H24N4O3S MolecularWeight: 436.52666

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CSC2=C1C=C(C=C2)[N+](=O)[O-])(N3CCN(CC3)C4=CC=CC5=C4C=CN5)O

Isomeric SMILES

CCC(C1=CSC2=C1C=C(C=C2)[N+](=O)[O-])(N3CCN(CC3)C4=CC=CC5=C4C=CN5)O

InChI

InChI=1S/C23H24N4O3S/c1-2-23(28,19-15-31-22-7-6-16(27(29)30)14-18(19)22)26-12-10-25(11-13-26)21-5-3-4-20-17(21)8-9-24-20/h3-9,14-15,24,28H,2,10-13H2,1H3