(3S)-3-[2-[4-(4-ethanoylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-propan-2-yl-piperazin-2-one

Systemtic Name: (3S)-3-[2-[4-(4-ethanoylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-propan-2-yl-piperazin-2-one Openeye Name: (3S)-3-[2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxo-ethyl]-4-isopropyl-piperazin-2-one CAS Name: (3S)-3-[2-[4-(4-acetylphenyl)-1-piperazinyl]-2-oxoethyl]-4-propan-2-yl-2-piperazinone IUPAC Name: (3S)-3-[2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl]-4-propan-2-ylpiperazin-2-one Traditional Name: (3S)-3-[2-[4-(4-acetylphenyl)piperazino]-2-keto-ethyl]-4-isopropyl-piperazin-2-one Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCNC(=O)C1CC(=O)N2CCN(CC2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC(C)N1CCNC(=O)[C@@H]1CC(=O)N2CCN(CC2)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H30N4O3/c1-15(2)25-9-8-22-21(28)19(25)14-20(27)24-12-10-23(11-13-24)18-6-4-17(5-7-18)16(3)26/h4-7,15,19H,8-14H2,1-3H3,(H,22,28)/t19-/m0/s1