5,8-dimethyl-3-[(1-phenethyl-1,2,3,4-tetrazol-5-yl)-thiomorpholin-4-yl-methyl]-1H-quinolin-2-one

Systemtic Name: 5,8-dimethyl-3-[(1-phenethyl-1,2,3,4-tetrazol-5-yl)-thiomorpholin-4-yl-methyl]-1H-quinolin-2-one Openeye Name: 5,8-dimethyl-3-[(1-phenethyltetrazol-5-yl)-thiomorpholino-methyl]-1H-quinolin-2-one CAS Name: 5,8-dimethyl-3-[(1-phenethyl-5-tetrazolyl)-thiomorpholin-4-ylmethyl]-1H-quinolin-2-one IUPAC Name: 5,8-dimethyl-3-[(1-phenethyltetrazol-5-yl)-thiomorpholin-4-ylmethyl]-1H-quinolin-2-one Traditional Name: 5,8-dimethyl-3-[(1-phenethyltetrazol-5-yl)-thiomorpholino-methyl]carbostyril Formula: C25H28N6OS MolecularWeight: 460.59442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)NC2=C(C=C1)C)C(C3=NN=NN3CCC4=CC=CC=C4)N5CCSCC5

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)C(C3=NN=NN3CCC4=CC=CC=C4)N5CCSCC5

InChI

InChI=1S/C25H28N6OS/c1-17-8-9-18(2)22-20(17)16-21(25(32)26-22)23(30-12-14-33-15-13-30)24-27-28-29-31(24)11-10-19-6-4-3-5-7-19/h3-9,16,23H,10-15H2,1-2H3,(H,26,32)