N-[4-(4-butylphenyl)-1,3-thiazol-2-yl]-3-cyano-benzamide

Systemtic Name: N-[4-(4-butylphenyl)-1,3-thiazol-2-yl]-3-cyano-benzamide Openeye Name: N-[4-(4-butylphenyl)thiazol-2-yl]-3-cyano-benzamide CAS Name: N-[4-(4-butylphenyl)-2-thiazolyl]-3-cyanobenzamide IUPAC Name: N-[4-(4-butylphenyl)-1,3-thiazol-2-yl]-3-cyanobenzamide Traditional Name: N-[4-(4-butylphenyl)thiazol-2-yl]-3-cyano-benzamide Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H19N3OS/c1-2-3-5-15-8-10-17(11-9-15)19-14-26-21(23-19)24-20(25)18-7-4-6-16(12-18)13-22/h4,6-12,14H,2-3,5H2,1H3,(H,23,24,25)