N-[3-azanyl-1-[4-[4-(oxidanylamino)-4-oxidanylidene-butyl]piperidin-1-yl]-1-oxidanylidene-propan-2-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[3-azanyl-1-[4-[4-(oxidanylamino)-4-oxidanylidene-butyl]piperidin-1-yl]-1-oxidanylidene-propan-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: N-[1-(aminomethyl)-2-[4-[4-(hydroxyamino)-4-oxo-butyl]-1-piperidyl]-2-oxo-ethyl]benzothiophene-2-carboxamide CAS Name: N-[3-amino-1-[4-[4-(hydroxyamino)-4-oxobutyl]-1-piperidinyl]-1-oxopropan-2-yl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[3-amino-1-[4-[4-(hydroxyamino)-4-oxobutyl]piperidin-1-yl]-1-oxopropan-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: N-[1-(aminomethyl)-2-[4-[4-(hydroxyamino)-4-keto-butyl]piperidino]-2-keto-ethyl]benzothiophene-2-carboxamide Formula: C21H28N4O4S MolecularWeight: 432.53642

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCCC(=O)NO)C(=O)C(CN)NC(=O)C2=CC3=CC=CC=C3S2

Isomeric SMILES

C1CN(CCC1CCCC(=O)NO)C(=O)C(CN)NC(=O)C2=CC3=CC=CC=C3S2

InChI

InChI=1S/C21H28N4O4S/c22-13-16(23-20(27)18-12-15-5-1-2-6-17(15)30-18)21(28)25-10-8-14(9-11-25)4-3-7-19(26)24-29/h1-2,5-6,12,14,16,29H,3-4,7-11,13,22H2,(H,23,27)(H,24,26)