2-heptadecyl-3-sulfanyl-1H-quinolin-4-one

Systemtic Name: 2-heptadecyl-3-sulfanyl-1H-quinolin-4-one Openeye Name: 2-heptadecyl-3-sulfanyl-1H-quinolin-4-one CAS Name: 2-heptadecyl-3-mercapto-1H-quinolin-4-one IUPAC Name: 2-heptadecyl-3-sulfanyl-1H-quinolin-4-one Traditional Name: 2-heptadecyl-3-mercapto-4-quinolone Formula: C26H41NOS MolecularWeight: 415.67484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=C(C(=O)C2=CC=CC=C2N1)S

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=C(C(=O)C2=CC=CC=C2N1)S

InChI

InChI=1S/C26H41NOS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-24-26(29)25(28)22-19-17-18-20-23(22)27-24/h17-20,29H,2-16,21H2,1H3,(H,27,28)