N-(4-methyl-2-piperidin-1-yl-quinolin-6-yl)-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide

Systemtic Name: N-(4-methyl-2-piperidin-1-yl-quinolin-6-yl)-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide Openeye Name: N-[4-methyl-2-(1-piperidyl)-6-quinolyl]-3-(2-thioxo-1,3-benzoxazol-3-yl)propanamide CAS Name: N-[4-methyl-2-(1-piperidinyl)-6-quinolinyl]-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide IUPAC Name: N-(4-methyl-2-piperidin-1-ylquinolin-6-yl)-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide Traditional Name: N-(4-methyl-2-piperidino-6-quinolyl)-3-(2-thioxo-1,3-benzoxazol-3-yl)propionamide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CCN3C4=CC=CC=C4OC3=S)N5CCCCC5

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CCN3C4=CC=CC=C4OC3=S)N5CCCCC5

InChI

InChI=1S/C25H26N4O2S/c1-17-15-23(28-12-5-2-6-13-28)27-20-10-9-18(16-19(17)20)26-24(30)11-14-29-21-7-3-4-8-22(21)31-25(29)32/h3-4,7-10,15-16H,2,5-6,11-14H2,1H3,(H,26,30)