5-methyl-1-[(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)methyl]indole-2,3-dione

Systemtic Name: 5-methyl-1-[(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)methyl]indole-2,3-dione Openeye Name: 5-methyl-1-[[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]methyl]indoline-2,3-dione CAS Name: 5-methyl-1-[[4-[oxo(thiophen-2-yl)methyl]-1-piperazin-1-iumyl]methyl]indole-2,3-dione IUPAC Name: 5-methyl-1-[[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]methyl]indole-2,3-dione Traditional Name: 5-methyl-1-[[4-(2-thenoyl)piperazin-1-ium-1-yl]methyl]isatin Formula: C19H20N3O3S+ MolecularWeight: 370.4454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C2=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C2=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C19H19N3O3S/c1-13-4-5-15-14(11-13)17(23)19(25)22(15)12-20-6-8-21(9-7-20)18(24)16-3-2-10-26-16/h2-5,10-11H,6-9,12H2,1H3/p+1