S-quinolin-3-yl 5-azanyl-2-(ethylamino)pentanethioate

Systemtic Name: S-quinolin-3-yl 5-azanyl-2-(ethylamino)pentanethioate Openeye Name: S-(3-quinolyl) 5-amino-2-(ethylamino)pentanethioate CAS Name: 5-amino-2-(ethylamino)pentanethioic acid S-(3-quinolinyl) ester IUPAC Name: S-quinolin-3-yl 5-amino-2-(ethylamino)pentanethioate Traditional Name: 5-amino-2-(ethylamino)pentanethioic acid S-(3-quinolyl) ester Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(CCCN)C(=O)SC1=CC2=CC=CC=C2N=C1

Isomeric SMILES

CCNC(CCCN)C(=O)SC1=CC2=CC=CC=C2N=C1

InChI

InChI=1S/C16H21N3OS/c1-2-18-15(8-5-9-17)16(20)21-13-10-12-6-3-4-7-14(12)19-11-13/h3-4,6-7,10-11,15,18H,2,5,8-9,17H2,1H3