(3Z)-6-chloranyl-3-[6-[(4-methylsulfonylpiperazin-1-yl)methyl]indol-2-ylidene]-1,2-dihydroindazole

Systemtic Name: (3Z)-6-chloranyl-3-[6-[(4-methylsulfonylpiperazin-1-yl)methyl]indol-2-ylidene]-1,2-dihydroindazole Openeye Name: (3Z)-6-chloro-3-[6-[(4-methylsulfonylpiperazin-1-yl)methyl]indol-2-ylidene]-1,2-dihydroindazole CAS Name: (3Z)-6-chloro-3-[6-[(4-methylsulfonyl-1-piperazinyl)methyl]-2-indolylidene]-1,2-dihydroindazole IUPAC Name: (3Z)-6-chloro-3-[6-[(4-methylsulfonylpiperazin-1-yl)methyl]indol-2-ylidene]-1,2-dihydroindazole Traditional Name: (3Z)-6-chloro-3-[6-[(4-mesylpiperazino)methyl]indol-2-ylidene]indazoline Formula: C21H22ClN5O2S MolecularWeight: 443.94968

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)CC2=CC3=NC(=C4C5=C(C=C(C=C5)Cl)NN4)C=C3C=C2

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)CC2=CC3=N/C(=C\4/C5=C(C=C(C=C5)Cl)NN4)/C=C3C=C2

InChI

InChI=1S/C21H22ClN5O2S/c1-30(28,29)27-8-6-26(7-9-27)13-14-2-3-15-11-20(23-18(15)10-14)21-17-5-4-16(22)12-19(17)24-25-21/h2-5,10-12,24-25H,6-9,13H2,1H3/b21-20-