2,6-dimethyl-4-[3-(phenylmethylsulfanyl)-1H-indazol-5-yl]-1,4-dihydropyridine-3,5-dicarbonitrile

Systemtic Name: 2,6-dimethyl-4-[3-(phenylmethylsulfanyl)-1H-indazol-5-yl]-1,4-dihydropyridine-3,5-dicarbonitrile Openeye Name: 4-(3-benzylsulfanyl-1H-indazol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile CAS Name: 2,6-dimethyl-4-[3-(phenylmethylthio)-1H-indazol-5-yl]-1,4-dihydropyridine-3,5-dicarbonitrile IUPAC Name: 4-(3-benzylsulfanyl-1H-indazol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile Traditional Name: 4-[3-(benzylthio)-1H-indazol-5-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile Formula: C23H19N5S MolecularWeight: 397.49546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C#N)C2=CC3=C(C=C2)NN=C3SCC4=CC=CC=C4)C#N

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C#N)C2=CC3=C(C=C2)NN=C3SCC4=CC=CC=C4)C#N

InChI

InChI=1S/C23H19N5S/c1-14-19(11-24)22(20(12-25)15(2)26-14)17-8-9-21-18(10-17)23(28-27-21)29-13-16-6-4-3-5-7-16/h3-10,22,26H,13H2,1-2H3,(H,27,28)