4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-N-[2-(4-phenylpiperazin-1-yl)ethyl]butanamide

Systemtic Name: 4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-N-[2-(4-phenylpiperazin-1-yl)ethyl]butanamide Openeye Name: 4-(2,5-dimethyl-3-thienyl)-4-oxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]butanamide CAS Name: 4-(2,5-dimethyl-3-thiophenyl)-4-oxo-N-[2-(4-phenyl-1-piperazinyl)ethyl]butanamide IUPAC Name: 4-(2,5-dimethylthiophen-3-yl)-4-oxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]butanamide Traditional Name: 4-(2,5-dimethyl-3-thienyl)-4-keto-N-[2-(4-phenylpiperazino)ethyl]butyramide Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)NCCN2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)NCCN2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C22H29N3O2S/c1-17-16-20(18(2)28-17)21(26)8-9-22(27)23-10-11-24-12-14-25(15-13-24)19-6-4-3-5-7-19/h3-7,16H,8-15H2,1-2H3,(H,23,27)