4-[3-[4-(1,3-benzothiazol-2-ylamino)phenoxy]pyrazin-2-yl]-6-methyl-piperazin-2-one

Systemtic Name: 4-[3-[4-(1,3-benzothiazol-2-ylamino)phenoxy]pyrazin-2-yl]-6-methyl-piperazin-2-one Openeye Name: 4-[3-[4-(1,3-benzothiazol-2-ylamino)phenoxy]pyrazin-2-yl]-6-methyl-piperazin-2-one CAS Name: 4-[3-[4-(1,3-benzothiazol-2-ylamino)phenoxy]-2-pyrazinyl]-6-methyl-2-piperazinone IUPAC Name: 4-[3-[4-(1,3-benzothiazol-2-ylamino)phenoxy]pyrazin-2-yl]-6-methylpiperazin-2-one Traditional Name: 4-[3-[4-(1,3-benzothiazol-2-ylamino)phenoxy]pyrazin-2-yl]-6-methyl-piperazin-2-one Formula: C22H20N6O2S MolecularWeight: 432.4982

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(=O)N1)C2=NC=CN=C2OC3=CC=C(C=C3)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1CN(CC(=O)N1)C2=NC=CN=C2OC3=CC=C(C=C3)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H20N6O2S/c1-14-12-28(13-19(29)25-14)20-21(24-11-10-23-20)30-16-8-6-15(7-9-16)26-22-27-17-4-2-3-5-18(17)31-22/h2-11,14H,12-13H2,1H3,(H,25,29)(H,26,27)