4-butoxy-6-[(E)-(cyclopropylamino)-(4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]quinoline-3-carbonitrile

Systemtic Name: 4-butoxy-6-[(E)-(cyclopropylamino)-(4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]quinoline-3-carbonitrile Openeye Name: 4-butoxy-6-[(E)-(cyclopropylamino)-(4-oxothiazol-5-ylidene)methyl]quinoline-3-carbonitrile CAS Name: 4-butoxy-6-[(E)-(cyclopropylamino)-(4-oxo-5-thiazolylidene)methyl]-3-quinolinecarbonitrile IUPAC Name: 4-butoxy-6-[(E)-(cyclopropylamino)-(4-oxo-1,3-thiazol-5-ylidene)methyl]quinoline-3-carbonitrile Traditional Name: 4-butoxy-6-[(E)-(cyclopropylamino)-(4-keto-2-thiazolin-5-ylidene)methyl]quinoline-3-carbonitrile Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C2C=C(C=CC2=NC=C1C#N)C(=C3C(=O)N=CS3)NC4CC4

Isomeric SMILES

CCCCOC1=C2C=C(C=CC2=NC=C1C#N)/C(=C\3/C(=O)N=CS3)/NC4CC4

InChI

InChI=1S/C21H20N4O2S/c1-2-3-8-27-19-14(10-22)11-23-17-7-4-13(9-16(17)19)18(25-15-5-6-15)20-21(26)24-12-28-20/h4,7,9,11-12,15,25H,2-3,5-6,8H2,1H3/b20-18+