2-azanyl-5-[3-oxidanyl-2-oxidanylidene-1-[[4-(phenylmethyl)piperazin-1-yl]methyl]indol-3-yl]-1,3-thiazol-4-one

Systemtic Name: 2-azanyl-5-[3-oxidanyl-2-oxidanylidene-1-[[4-(phenylmethyl)piperazin-1-yl]methyl]indol-3-yl]-1,3-thiazol-4-one Openeye Name: 2-amino-5-[1-[(4-benzylpiperazin-1-yl)methyl]-3-hydroxy-2-oxo-indolin-3-yl]thiazol-4-one CAS Name: 2-amino-5-[3-hydroxy-2-oxo-1-[[4-(phenylmethyl)-1-piperazinyl]methyl]-3-indolyl]-4-thiazolone IUPAC Name: 2-amino-5-[1-[(4-benzylpiperazin-1-yl)methyl]-3-hydroxy-2-oxoindol-3-yl]-1,3-thiazol-4-one Traditional Name: 2-amino-5-[1-[(4-benzylpiperazino)methyl]-3-hydroxy-2-keto-indolin-3-yl]-2-thiazolin-4-one Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CN3C4=CC=CC=C4C(C3=O)(C5C(=O)N=C(S5)N)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CN3C4=CC=CC=C4C(C3=O)(C5C(=O)N=C(S5)N)O

InChI

InChI=1S/C23H25N5O3S/c24-22-25-20(29)19(32-22)23(31)17-8-4-5-9-18(17)28(21(23)30)15-27-12-10-26(11-13-27)14-16-6-2-1-3-7-16/h1-9,19,31H,10-15H2,(H2,24,25,29)