N-(2-aminophenyl)-6-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-aminophenyl)-6-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-aminophenyl)-6-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]benzothiophene-2-carboxamide CAS Name: N-(2-aminophenyl)-6-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-aminophenyl)-6-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-aminophenyl)-6-[2-keto-2-(4-methylpiperazino)ethyl]benzothiophene-2-carboxamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CC2=CC3=C(C=C2)C=C(S3)C(=O)NC4=CC=CC=C4N

Isomeric SMILES

CN1CCN(CC1)C(=O)CC2=CC3=C(C=C2)C=C(S3)C(=O)NC4=CC=CC=C4N

InChI

InChI=1S/C22H24N4O2S/c1-25-8-10-26(11-9-25)21(27)13-15-6-7-16-14-20(29-19(16)12-15)22(28)24-18-5-3-2-4-17(18)23/h2-7,12,14H,8-11,13,23H2,1H3,(H,24,28)