6-cyano-N-[3-(dimethylamino)propyl]benzo[e][1]benzothiole-4-carboxamide

Systemtic Name: 6-cyano-N-[3-(dimethylamino)propyl]benzo[e][1]benzothiole-4-carboxamide Openeye Name: 6-cyano-N-[3-(dimethylamino)propyl]benzo[e]benzothiophene-4-carboxamide CAS Name: 6-cyano-N-[3-(dimethylamino)propyl]-4-benzo[e][1]benzothiolecarboxamide IUPAC Name: 6-cyano-N-[3-(dimethylamino)propyl]benzo[e][1]benzothiole-4-carboxamide Traditional Name: 6-cyano-N-[3-(dimethylamino)propyl]benzo[e]benzothiophene-4-carboxamide Formula: C19H19N3OS MolecularWeight: 337.43866

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=O)C1=CC2=C(C=CC=C2C3=C1SC=C3)C#N

Isomeric SMILES

CN(C)CCCNC(=O)C1=CC2=C(C=CC=C2C3=C1SC=C3)C#N

InChI

InChI=1S/C19H19N3OS/c1-22(2)9-4-8-21-19(23)17-11-16-13(12-20)5-3-6-14(16)15-7-10-24-18(15)17/h3,5-7,10-11H,4,8-9H2,1-2H3,(H,21,23)