1-(4-butylphenyl)sulfonyl-4-piperazin-1-yl-indole

Systemtic Name: 1-(4-butylphenyl)sulfonyl-4-piperazin-1-yl-indole Openeye Name: 1-(4-butylphenyl)sulfonyl-4-piperazin-1-yl-indole CAS Name: 1-(4-butylphenyl)sulfonyl-4-(1-piperazinyl)indole IUPAC Name: 1-(4-butylphenyl)sulfonyl-4-piperazin-1-ylindole Traditional Name: 1-(4-butylphenyl)sulfonyl-4-piperazino-indole Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC=C3N4CCNCC4

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC=C3N4CCNCC4

InChI

InChI=1S/C22H27N3O2S/c1-2-3-5-18-8-10-19(11-9-18)28(26,27)25-15-12-20-21(6-4-7-22(20)25)24-16-13-23-14-17-24/h4,6-12,15,23H,2-3,5,13-14,16-17H2,1H3