(E)-N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[2-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-2-oxoethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-oxoethyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]-2-keto-ethyl]-3-phenyl-acrylamide Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3S2)C(=O)CNC(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3S2)C(=O)CNC(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C23H24N4O2S/c28-21(11-10-18-6-2-1-3-7-18)24-16-23(29)27-14-12-26(13-15-27)17-22-25-19-8-4-5-9-20(19)30-22/h1-11H,12-17H2,(H,24,28)/b11-10+