N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanamide

Systemtic Name: N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-[4-(3,4-dimethylphenyl)thiazol-2-yl]-4-oxo-butanamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-[4-(3,4-dimethylphenyl)-2-thiazolyl]-4-oxobutanamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-oxobutanamide Traditional Name: 4-(4-acetylpiperazino)-N-[4-(3,4-dimethylphenyl)thiazol-2-yl]-4-keto-butyramide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CCC(=O)N3CCN(CC3)C(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CCC(=O)N3CCN(CC3)C(=O)C)C

InChI

InChI=1S/C21H26N4O3S/c1-14-4-5-17(12-15(14)2)18-13-29-21(22-18)23-19(27)6-7-20(28)25-10-8-24(9-11-25)16(3)26/h4-5,12-13H,6-11H2,1-3H3,(H,22,23,27)