5-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]sulfonyl-2-propoxy-phenyl]-1-ethyl-3-propyl-6H-indazole-7-thione

Systemtic Name: 5-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]sulfonyl-2-propoxy-phenyl]-1-ethyl-3-propyl-6H-indazole-7-thione Openeye Name: 5-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]sulfonyl-2-propoxy-phenyl]-1-ethyl-3-propyl-6H-indazole-7-thione CAS Name: 5-[5-[[(3S,5R)-3,5-dimethyl-1-piperazinyl]sulfonyl]-2-propoxyphenyl]-1-ethyl-3-propyl-6H-indazole-7-thione IUPAC Name: 5-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]sulfonyl-2-propoxyphenyl]-1-ethyl-3-propyl-6H-indazole-7-thione Traditional Name: 5-[5-[(3S,5R)-3,5-dimethylpiperazino]sulfonyl-2-propoxy-phenyl]-1-ethyl-3-propyl-6H-indazole-7-thione Formula: C27H38N4O3S2 MolecularWeight: 530.74562

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1C=C(CC2=S)C3=C(C=CC(=C3)S(=O)(=O)N4CC(NC(C4)C)C)OCCC)CC

Isomeric SMILES

CCCC1=NN(C2=C1C=C(CC2=S)C3=C(C=CC(=C3)S(=O)(=O)N4C[C@H](N[C@H](C4)C)C)OCCC)CC

InChI

InChI=1S/C27H38N4O3S2/c1-6-9-24-23-13-20(14-26(35)27(23)31(8-3)29-24)22-15-21(10-11-25(22)34-12-7-2)36(32,33)30-16-18(4)28-19(5)17-30/h10-11,13,15,18-19,28H,6-9,12,14,16-17H2,1-5H3/t18-,19+