2-(4-methylquinolin-2-yl)sulfanyl-N-[[2-(4-methylquinolin-2-yl)sulfanylethanoylamino]-phenyl-methyl]ethanamide

Systemtic Name: 2-(4-methylquinolin-2-yl)sulfanyl-N-[[2-(4-methylquinolin-2-yl)sulfanylethanoylamino]-phenyl-methyl]ethanamide Openeye Name: 2-[(4-methyl-2-quinolyl)sulfanyl]-N-[[[2-[(4-methyl-2-quinolyl)sulfanyl]acetyl]amino]-phenyl-methyl]acetamide CAS Name: 2-[(4-methyl-2-quinolinyl)thio]-N-[[[2-[(4-methyl-2-quinolinyl)thio]-1-oxoethyl]amino]-phenylmethyl]acetamide IUPAC Name: 2-(4-methylquinolin-2-yl)sulfanyl-N-[[[2-(4-methylquinolin-2-yl)sulfanylacetyl]amino]-phenylmethyl]acetamide Traditional Name: 2-[(4-methyl-2-quinolyl)thio]-N-[[[2-[(4-methyl-2-quinolyl)thio]acetyl]amino]-phenyl-methyl]acetamide Formula: C31H28N4O2S2 MolecularWeight: 552.70962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC(C3=CC=CC=C3)NC(=O)CSC4=NC5=CC=CC=C5C(=C4)C

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC(C3=CC=CC=C3)NC(=O)CSC4=NC5=CC=CC=C5C(=C4)C

InChI

InChI=1S/C31H28N4O2S2/c1-20-16-29(32-25-14-8-6-12-23(20)25)38-18-27(36)34-31(22-10-4-3-5-11-22)35-28(37)19-39-30-17-21(2)24-13-7-9-15-26(24)33-30/h3-17,31H,18-19H2,1-2H3,(H,34,36)(H,35,37)