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

Systemtic Name: 4-[2-[5-azanyl-3-oxidanylidene-1-(pyridin-3-ylmethyl)-2H-pyrrol-4-yl]-1,3-thiazol-4-yl]benzenecarbonitrile Openeye Name: 4-[2-[5-amino-3-oxo-1-(3-pyridylmethyl)-2H-pyrrol-4-yl]thiazol-4-yl]benzonitrile CAS Name: 4-[2-[5-amino-3-oxo-1-(3-pyridinylmethyl)-2H-pyrrol-4-yl]-4-thiazolyl]benzonitrile IUPAC Name: 4-[2-[5-amino-3-oxo-1-(pyridin-3-ylmethyl)-2H-pyrrol-4-yl]-1,3-thiazol-4-yl]benzonitrile Traditional Name: 4-[2-[2-amino-4-keto-1-(3-pyridylmethyl)-2-pyrrolin-3-yl]thiazol-4-yl]benzonitrile Formula: C20H15N5OS MolecularWeight: 373.431

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(N1CC2=CN=CC=C2)N)C3=NC(=CS3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1C(=O)C(=C(N1CC2=CN=CC=C2)N)C3=NC(=CS3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C20H15N5OS/c21-8-13-3-5-15(6-4-13)16-12-27-20(24-16)18-17(26)11-25(19(18)22)10-14-2-1-7-23-9-14/h1-7,9,12H,10-11,22H2