2-[[1,3-bis(oxidanylidene)-2-pyridin-2-yl-isoquinolin-4-ylidene]methylamino]thiophene-3-carboxamide

Systemtic Name: 2-[[1,3-bis(oxidanylidene)-2-pyridin-2-yl-isoquinolin-4-ylidene]methylamino]thiophene-3-carboxamide Openeye Name: 2-[[1,3-dioxo-2-(2-pyridyl)-4-isoquinolylidene]methylamino]thiophene-3-carboxamide CAS Name: 2-[[1,3-dioxo-2-(2-pyridinyl)-4-isoquinolinylidene]methylamino]-3-thiophenecarboxamide IUPAC Name: 2-[(1,3-dioxo-2-pyridin-2-ylisoquinolin-4-ylidene)methylamino]thiophene-3-carboxamide Traditional Name: 2-[[1,3-diketo-2-(2-pyridyl)-4-isoquinolylidene]methylamino]thiophene-3-carboxamide Formula: C20H14N4O3S MolecularWeight: 390.41516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CNC3=C(C=CS3)C(=O)N)C(=O)N(C2=O)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CNC3=C(C=CS3)C(=O)N)C(=O)N(C2=O)C4=CC=CC=N4

InChI

InChI=1S/C20H14N4O3S/c21-17(25)14-8-10-28-18(14)23-11-15-12-5-1-2-6-13(12)19(26)24(20(15)27)16-7-3-4-9-22-16/h1-11,23H,(H2,21,25)