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

Systemtic Name: 1-[4-[4-(1,3-benzothiazol-6-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-[4-(1,3-benzothiazol-6-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[4-(1,3-benzothiazol-6-ylamino)-2-pyrimidinyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-[4-(1,3-benzothiazol-6-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-[4-(1,3-benzothiazol-6-ylamino)pyrimidin-2-yl]piperazino]-2-methyl-propan-1-one Formula: C19H22N6OS MolecularWeight: 382.48258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C2=NC=CC(=N2)NC3=CC4=C(C=C3)N=CS4

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C2=NC=CC(=N2)NC3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C19H22N6OS/c1-13(2)18(26)24-7-9-25(10-8-24)19-20-6-5-17(23-19)22-14-3-4-15-16(11-14)27-12-21-15/h3-6,11-13H,7-10H2,1-2H3,(H,20,22,23)