N-[4-azanyl-5-oxidanylidene-5-(1,3-thiazolidin-3-yl)pentyl]isoquinoline-3-carboxamide

Systemtic Name: N-[4-azanyl-5-oxidanylidene-5-(1,3-thiazolidin-3-yl)pentyl]isoquinoline-3-carboxamide Openeye Name: N-(4-amino-5-oxo-5-thiazolidin-3-yl-pentyl)isoquinoline-3-carboxamide CAS Name: N-[4-amino-5-oxo-5-(3-thiazolidinyl)pentyl]-3-isoquinolinecarboxamide IUPAC Name: N-[4-amino-5-oxo-5-(1,3-thiazolidin-3-yl)pentyl]isoquinoline-3-carboxamide Traditional Name: N-(4-amino-5-keto-5-thiazolidin-3-yl-pentyl)isoquinoline-3-carboxamide Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCN1C(=O)C(CCCNC(=O)C2=CC3=CC=CC=C3C=N2)N

Isomeric SMILES

C1CSCN1C(=O)C(CCCNC(=O)C2=CC3=CC=CC=C3C=N2)N

InChI

InChI=1S/C18H22N4O2S/c19-15(18(24)22-8-9-25-12-22)6-3-7-20-17(23)16-10-13-4-1-2-5-14(13)11-21-16/h1-2,4-5,10-11,15H,3,6-9,12,19H2,(H,20,23)