4-[2-[5-azanyl-1-(3-methylbutyl)-3-oxidanylidene-2H-pyrrol-4-yl]-1,3-thiazol-4-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[5-azanyl-1-(3-methylbutyl)-3-oxidanylidene-2H-pyrrol-4-yl]-1,3-thiazol-4-yl]benzenecarbonitrile Openeye Name: 4-[2-(5-amino-1-isopentyl-3-oxo-2H-pyrrol-4-yl)thiazol-4-yl]benzonitrile CAS Name: 4-[2-[5-amino-1-(3-methylbutyl)-3-oxo-2H-pyrrol-4-yl]-4-thiazolyl]benzonitrile IUPAC Name: 4-[2-[5-amino-1-(3-methylbutyl)-3-oxo-2H-pyrrol-4-yl]-1,3-thiazol-4-yl]benzonitrile Traditional Name: 4-[2-(2-amino-1-isoamyl-4-keto-2-pyrrolin-3-yl)thiazol-4-yl]benzonitrile Formula: C19H20N4OS MolecularWeight: 352.4533

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1CC(=O)C(=C1N)C2=NC(=CS2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)CCN1CC(=O)C(=C1N)C2=NC(=CS2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H20N4OS/c1-12(2)7-8-23-10-16(24)17(18(23)21)19-22-15(11-25-19)14-5-3-13(9-20)4-6-14/h3-6,11-12H,7-8,10,21H2,1-2H3