4-(isoquinolin-4-ylmethylideneamino)thiolan-3-one

Systemtic Name: 4-(isoquinolin-4-ylmethylideneamino)thiolan-3-one Openeye Name: 4-(4-isoquinolylmethyleneamino)tetrahydrothiophen-3-one CAS Name: 4-(4-isoquinolinylmethylideneamino)-3-thiolanone IUPAC Name: 4-(isoquinolin-4-ylmethylideneamino)thiolan-3-one Traditional Name: 4-(4-isoquinolylmethyleneamino)tetrahydrothiophen-3-one Formula: C14H12N2OS MolecularWeight: 256.32288

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)CS1)N=CC2=CN=CC3=CC=CC=C32

Isomeric SMILES

C1C(C(=O)CS1)N=CC2=CN=CC3=CC=CC=C32

InChI

InChI=1S/C14H12N2OS/c17-14-9-18-8-13(14)16-7-11-6-15-5-10-3-1-2-4-12(10)11/h1-7,13H,8-9H2