N-[4-methylsulfanyl-1-oxidanylidene-1-(quinolin-3-ylamino)butan-2-yl]benzamide

Systemtic Name: N-[4-methylsulfanyl-1-oxidanylidene-1-(quinolin-3-ylamino)butan-2-yl]benzamide Openeye Name: N-[3-methylsulfanyl-1-(3-quinolylcarbamoyl)propyl]benzamide CAS Name: N-[4-(methylthio)-1-oxo-1-(3-quinolinylamino)butan-2-yl]benzamide IUPAC Name: N-[4-methylsulfanyl-1-oxo-1-(quinolin-3-ylamino)butan-2-yl]benzamide Traditional Name: N-[3-(methylthio)-1-(3-quinolylcarbamoyl)propyl]benzamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC2=CC=CC=C2N=C1)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CSCCC(C(=O)NC1=CC2=CC=CC=C2N=C1)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S/c1-27-12-11-19(24-20(25)15-7-3-2-4-8-15)21(26)23-17-13-16-9-5-6-10-18(16)22-14-17/h2-10,13-14,19H,11-12H2,1H3,(H,23,26)(H,24,25)