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

Systemtic Name: 3-[[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl-(thiophen-2-ylmethyl)amino]methyl]-6-ethyl-1H-quinolin-2-one Openeye Name: 3-[[(1-cyclohexyltetrazol-5-yl)methyl-(2-thienylmethyl)amino]methyl]-6-ethyl-1H-quinolin-2-one CAS Name: 3-[[(1-cyclohexyl-5-tetrazolyl)methyl-(thiophen-2-ylmethyl)amino]methyl]-6-ethyl-1H-quinolin-2-one IUPAC Name: 3-[[(1-cyclohexyltetrazol-5-yl)methyl-(thiophen-2-ylmethyl)amino]methyl]-6-ethyl-1H-quinolin-2-one Traditional Name: 3-[[(1-cyclohexyltetrazol-5-yl)methyl-(2-thenyl)amino]methyl]-6-ethyl-carbostyril Formula: C25H30N6OS MolecularWeight: 462.6103

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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=NN4C5CCCCC5

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CS3)CC4=NN=NN4C5CCCCC5

InChI

InChI=1S/C25H30N6OS/c1-2-18-10-11-23-19(13-18)14-20(25(32)26-23)15-30(16-22-9-6-12-33-22)17-24-27-28-29-31(24)21-7-4-3-5-8-21/h6,9-14,21H,2-5,7-8,15-17H2,1H3,(H,26,32)