N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-3-methyl-benzamide

Systemtic Name: N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-3-methyl-benzamide Openeye Name: N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]-3-methyl-benzamide CAS Name: N-[2-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-2-oxoethyl]-3-methylbenzamide IUPAC Name: N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-oxoethyl]-3-methylbenzamide Traditional Name: N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]-2-keto-ethyl]-3-methyl-benzamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H24N4O2S/c1-16-5-4-6-17(13-16)22(28)23-14-21(27)26-11-9-25(10-12-26)15-20-24-18-7-2-3-8-19(18)29-20/h2-8,13H,9-12,14-15H2,1H3,(H,23,28)