N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-4-(4-ethanoylpiperazin-1-yl)-N-methyl-4-oxidanylidene-butanamide

Systemtic Name: N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-4-(4-ethanoylpiperazin-1-yl)-N-methyl-4-oxidanylidene-butanamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-oxo-butanamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-oxobutanamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-oxobutanamide Traditional Name: 4-(4-acetylpiperazino)-N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-4-keto-N-methyl-butyramide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)CCC(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

C[C@@H](C1=NC2=CC=CC=C2S1)N(C)C(=O)CCC(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C20H26N4O3S/c1-14(20-21-16-6-4-5-7-17(16)28-20)22(3)18(26)8-9-19(27)24-12-10-23(11-13-24)15(2)25/h4-7,14H,8-13H2,1-3H3/t14-/m0/s1