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

Systemtic Name: 2-azanyl-5-[1-[(4-methylpiperazin-1-yl)methyl]-3-oxidanyl-2-oxidanylidene-indol-3-yl]-1,3-thiazol-4-one Openeye Name: 2-amino-5-[3-hydroxy-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-indolin-3-yl]thiazol-4-one CAS Name: 2-amino-5-[3-hydroxy-1-[(4-methyl-1-piperazinyl)methyl]-2-oxo-3-indolyl]-4-thiazolone IUPAC Name: 2-amino-5-[3-hydroxy-1-[(4-methylpiperazin-1-yl)methyl]-2-oxoindol-3-yl]-1,3-thiazol-4-one Traditional Name: 2-amino-5-[3-hydroxy-2-keto-1-[(4-methylpiperazino)methyl]indolin-3-yl]-2-thiazolin-4-one Formula: C17H21N5O3S MolecularWeight: 375.44534

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CN2C3=CC=CC=C3C(C2=O)(C4C(=O)N=C(S4)N)O

Isomeric SMILES

CN1CCN(CC1)CN2C3=CC=CC=C3C(C2=O)(C4C(=O)N=C(S4)N)O

InChI

InChI=1S/C17H21N5O3S/c1-20-6-8-21(9-7-20)10-22-12-5-3-2-4-11(12)17(25,15(22)24)13-14(23)19-16(18)26-13/h2-5,13,25H,6-10H2,1H3,(H2,18,19,23)