3-[[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl-(thiophen-2-ylmethyl)amino]methyl]-6-ethyl-1H-quinolin-2-one

Systemtic Name: 3-[[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl-(thiophen-2-ylmethyl)amino]methyl]-6-ethyl-1H-quinolin-2-one Openeye Name: 3-[[(1-tert-butyltetrazol-5-yl)methyl-(2-thienylmethyl)amino]methyl]-6-ethyl-1H-quinolin-2-one CAS Name: 3-[[(1-tert-butyl-5-tetrazolyl)methyl-(thiophen-2-ylmethyl)amino]methyl]-6-ethyl-1H-quinolin-2-one IUPAC Name: 3-[[(1-tert-butyltetrazol-5-yl)methyl-(thiophen-2-ylmethyl)amino]methyl]-6-ethyl-1H-quinolin-2-one Traditional Name: 3-[[(1-tert-butyltetrazol-5-yl)methyl-(2-thenyl)amino]methyl]-6-ethyl-carbostyril Formula: C23H28N6OS MolecularWeight: 436.57302

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CS3)CC4=NN=NN4C(C)(C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CS3)CC4=NN=NN4C(C)(C)C

InChI

InChI=1S/C23H28N6OS/c1-5-16-8-9-20-17(11-16)12-18(22(30)24-20)13-28(14-19-7-6-10-31-19)15-21-25-26-27-29(21)23(2,3)4/h6-12H,5,13-15H2,1-4H3,(H,24,30)