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

Systemtic Name: 4-ethoxy-6-[(Z)-[2-(2-imidazol-1-ylethylamino)-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]quinoline-3-carbonitrile Openeye Name: 4-ethoxy-6-[(Z)-[2-(2-imidazol-1-ylethylamino)-4-oxo-thiazol-5-ylidene]methyl]quinoline-3-carbonitrile CAS Name: 4-ethoxy-6-[(Z)-[2-[2-(1-imidazolyl)ethylamino]-4-oxo-5-thiazolylidene]methyl]-3-quinolinecarbonitrile IUPAC Name: 4-ethoxy-6-[(Z)-[2-(2-imidazol-1-ylethylamino)-4-oxo-1,3-thiazol-5-ylidene]methyl]quinoline-3-carbonitrile Traditional Name: 4-ethoxy-6-[(Z)-[2-(2-imidazol-1-ylethylamino)-4-keto-2-thiazolin-5-ylidene]methyl]quinoline-3-carbonitrile Formula: C21H18N6O2S MolecularWeight: 418.47162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C=C(C=CC2=NC=C1C#N)C=C3C(=O)N=C(S3)NCCN4C=CN=C4

Isomeric SMILES

CCOC1=C2C=C(C=CC2=NC=C1C#N)/C=C\3/C(=O)N=C(S3)NCCN4C=CN=C4

InChI

InChI=1S/C21H18N6O2S/c1-2-29-19-15(11-22)12-25-17-4-3-14(9-16(17)19)10-18-20(28)26-21(30-18)24-6-8-27-7-5-23-13-27/h3-5,7,9-10,12-13H,2,6,8H2,1H3,(H,24,26,28)/b18-10-