4-[[(2R)-2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoyl]amino]benzamide

Systemtic Name: 4-[[(2R)-2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoyl]amino]benzamide Openeye Name: 4-[[(2R)-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]propanoyl]amino]benzamide CAS Name: 4-[[(2R)-2-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxopropyl]amino]benzamide IUPAC Name: 4-[[(2R)-2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoyl]amino]benzamide Traditional Name: 4-[[(2R)-2-[(4,8-dimethyl-2-quinolyl)thio]propanoyl]amino]benzamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SC(C)C(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)S[C@H](C)C(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C21H21N3O2S/c1-12-5-4-6-17-13(2)11-18(24-19(12)17)27-14(3)21(26)23-16-9-7-15(8-10-16)20(22)25/h4-11,14H,1-3H3,(H2,22,25)(H,23,26)/t14-/m1/s1