N-[1-[4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoyl]piperidin-4-yl]-2-methyl-benzamide

Systemtic Name: N-[1-[4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoyl]piperidin-4-yl]-2-methyl-benzamide Openeye Name: N-[1-[4-(2,5-dimethyl-3-thienyl)-4-oxo-butanoyl]-4-piperidyl]-2-methyl-benzamide CAS Name: N-[1-[4-(2,5-dimethyl-3-thiophenyl)-1,4-dioxobutyl]-4-piperidinyl]-2-methylbenzamide IUPAC Name: N-[1-[4-(2,5-dimethylthiophen-3-yl)-4-oxobutanoyl]piperidin-4-yl]-2-methylbenzamide Traditional Name: N-[1-[4-(2,5-dimethyl-3-thienyl)-4-keto-butanoyl]-4-piperidyl]-2-methyl-benzamide Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2CCN(CC2)C(=O)CCC(=O)C3=C(SC(=C3)C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2CCN(CC2)C(=O)CCC(=O)C3=C(SC(=C3)C)C

InChI

InChI=1S/C23H28N2O3S/c1-15-6-4-5-7-19(15)23(28)24-18-10-12-25(13-11-18)22(27)9-8-21(26)20-14-16(2)29-17(20)3/h4-7,14,18H,8-13H2,1-3H3,(H,24,28)