7-[[[5-(3-oxidanylpentan-3-yl)-1,3,4-thiadiazol-2-yl]amino]methyl]-4-phenyl-quinoline-2-carbonitrile

Systemtic Name: 7-[[[5-(3-oxidanylpentan-3-yl)-1,3,4-thiadiazol-2-yl]amino]methyl]-4-phenyl-quinoline-2-carbonitrile Openeye Name: 7-[[[5-(1-ethyl-1-hydroxy-propyl)-1,3,4-thiadiazol-2-yl]amino]methyl]-4-phenyl-quinoline-2-carbonitrile CAS Name: 7-[[[5-(3-hydroxypentan-3-yl)-1,3,4-thiadiazol-2-yl]amino]methyl]-4-phenyl-2-quinolinecarbonitrile IUPAC Name: 7-[[[5-(3-hydroxypentan-3-yl)-1,3,4-thiadiazol-2-yl]amino]methyl]-4-phenylquinoline-2-carbonitrile Traditional Name: 7-[[[5-(1-ethyl-1-hydroxy-propyl)-1,3,4-thiadiazol-2-yl]amino]methyl]-4-phenyl-quinaldonitrile Formula: C24H23N5OS MolecularWeight: 429.53732

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=NN=C(S1)NCC2=CC3=NC(=CC(=C3C=C2)C4=CC=CC=C4)C#N)O

Isomeric SMILES

CCC(CC)(C1=NN=C(S1)NCC2=CC3=NC(=CC(=C3C=C2)C4=CC=CC=C4)C#N)O

InChI

InChI=1S/C24H23N5OS/c1-3-24(30,4-2)22-28-29-23(31-22)26-15-16-10-11-19-20(17-8-6-5-7-9-17)13-18(14-25)27-21(19)12-16/h5-13,30H,3-4,15H2,1-2H3,(H,26,29)