4-[[4-(5,7-dihydrothieno[3,4-b]pyridin-5-ylsulfonyl)-2-oxidanylidene-piperazin-1-yl]methyl]benzenecarboximidamide

Systemtic Name: 4-[[4-(5,7-dihydrothieno[3,4-b]pyridin-5-ylsulfonyl)-2-oxidanylidene-piperazin-1-yl]methyl]benzenecarboximidamide Openeye Name: 4-[[4-(5,7-dihydrothieno[3,4-b]pyridin-5-ylsulfonyl)-2-oxo-piperazin-1-yl]methyl]benzamidine CAS Name: 4-[[4-(5,7-dihydrothieno[3,4-b]pyridin-5-ylsulfonyl)-2-oxo-1-piperazinyl]methyl]benzenecarboximidamide IUPAC Name: 4-[[4-(5,7-dihydrothieno[3,4-b]pyridin-5-ylsulfonyl)-2-oxopiperazin-1-yl]methyl]benzenecarboximidamide Traditional Name: 4-[[4-(5,7-dihydrothieno[3,4-b]pyridin-5-ylsulfonyl)-2-keto-piperazino]methyl]benzamidine Formula: C19H21N5O3S2 MolecularWeight: 431.53174

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1S(=O)(=O)C2C3=C(CS2)N=CC=C3)CC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C1CN(C(=O)CN1S(=O)(=O)C2C3=C(CS2)N=CC=C3)CC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C19H21N5O3S2/c20-18(21)14-5-3-13(4-6-14)10-23-8-9-24(11-17(23)25)29(26,27)19-15-2-1-7-22-16(15)12-28-19/h1-7,19H,8-12H2,(H3,20,21)