4-ethoxy-6-[(Z)-[2-(oxan-4-ylmethylamino)-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]quinoline-3-carbonitrile

Systemtic Name: 4-ethoxy-6-[(Z)-[2-(oxan-4-ylmethylamino)-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]quinoline-3-carbonitrile Openeye Name: 4-ethoxy-6-[(Z)-[4-oxo-2-(tetrahydropyran-4-ylmethylamino)thiazol-5-ylidene]methyl]quinoline-3-carbonitrile CAS Name: 4-ethoxy-6-[(Z)-[2-(4-oxanylmethylamino)-4-oxo-5-thiazolylidene]methyl]-3-quinolinecarbonitrile IUPAC Name: 4-ethoxy-6-[(Z)-[2-(oxan-4-ylmethylamino)-4-oxo-1,3-thiazol-5-ylidene]methyl]quinoline-3-carbonitrile Traditional Name: 4-ethoxy-6-[(Z)-[4-keto-2-(tetrahydropyran-4-ylmethylamino)-2-thiazolin-5-ylidene]methyl]quinoline-3-carbonitrile Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C=C(C=CC2=NC=C1C#N)C=C3C(=O)N=C(S3)NCC4CCOCC4

Isomeric SMILES

CCOC1=C2C=C(C=CC2=NC=C1C#N)/C=C\3/C(=O)N=C(S3)NCC4CCOCC4

InChI

InChI=1S/C22H22N4O3S/c1-2-29-20-16(11-23)13-24-18-4-3-15(9-17(18)20)10-19-21(27)26-22(30-19)25-12-14-5-7-28-8-6-14/h3-4,9-10,13-14H,2,5-8,12H2,1H3,(H,25,26,27)/b19-10-