4-[4,6-bis(diethylamino)-3,5-diethyl-pyridin-2-yl]-2-phenyl-1,3-thiazole-5-carbonitrile

Systemtic Name: 4-[4,6-bis(diethylamino)-3,5-diethyl-pyridin-2-yl]-2-phenyl-1,3-thiazole-5-carbonitrile Openeye Name: 4-[4,6-bis(diethylamino)-3,5-diethyl-2-pyridyl]-2-phenyl-thiazole-5-carbonitrile CAS Name: 4-[4,6-bis(diethylamino)-3,5-diethyl-2-pyridinyl]-2-phenyl-5-thiazolecarbonitrile IUPAC Name: 4-[4,6-bis(diethylamino)-3,5-diethylpyridin-2-yl]-2-phenyl-1,3-thiazole-5-carbonitrile Traditional Name: 4-[4,6-bis(diethylamino)-3,5-diethyl-2-pyridyl]-2-phenyl-thiazole-5-carbonitrile Formula: C27H35N5S MolecularWeight: 461.6653

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N=C1C2=C(SC(=N2)C3=CC=CC=C3)C#N)N(CC)CC)CC)N(CC)CC

Isomeric SMILES

CCC1=C(C(=C(N=C1C2=C(SC(=N2)C3=CC=CC=C3)C#N)N(CC)CC)CC)N(CC)CC

InChI

InChI=1S/C27H35N5S/c1-7-20-23(24-22(18-28)33-27(30-24)19-16-14-13-15-17-19)29-26(32(11-5)12-6)21(8-2)25(20)31(9-3)10-4/h13-17H,7-12H2,1-6H3