3-[(5-ethyl-1-sulfanylidene-6,7,8,9-tetrahydro-3H-pyrrolo[3,4-c]isoquinolin-2-yl)carbonyl]chromen-2-one

Systemtic Name: 3-[(5-ethyl-1-sulfanylidene-6,7,8,9-tetrahydro-3H-pyrrolo[3,4-c]isoquinolin-2-yl)carbonyl]chromen-2-one Openeye Name: 3-(5-ethyl-1-thioxo-6,7,8,9-tetrahydro-3H-pyrrolo[3,4-c]isoquinoline-2-carbonyl)chromen-2-one CAS Name: 3-[(5-ethyl-1-sulfanylidene-6,7,8,9-tetrahydro-3H-pyrrolo[3,4-c]isoquinolin-2-yl)-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-(5-ethyl-1-sulfanylidene-6,7,8,9-tetrahydro-3H-pyrrolo[3,4-c]isoquinoline-2-carbonyl)chromen-2-one Traditional Name: 3-(5-ethyl-1-thioxo-6,7,8,9-tetrahydro-3H-pyrrol[3,4-c]isoquinoline-2-carbonyl)coumarin Formula: C23H20N2O3S MolecularWeight: 404.4815

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2CCCCC2=C3C(=N1)CN(C3=S)C(=O)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

CCC1=C2CCCCC2=C3C(=N1)CN(C3=S)C(=O)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C23H20N2O3S/c1-2-17-14-8-4-5-9-15(14)20-18(24-17)12-25(22(20)29)21(26)16-11-13-7-3-6-10-19(13)28-23(16)27/h3,6-7,10-11H,2,4-5,8-9,12H2,1H3