[4-methoxy-2-(4-methylpiperazin-1-yl)-1,3-benzothiazol-7-yl] N-(4-cyano-2-methyl-pyrazol-3-yl)carbamate

Systemtic Name: [4-methoxy-2-(4-methylpiperazin-1-yl)-1,3-benzothiazol-7-yl] N-(4-cyano-2-methyl-pyrazol-3-yl)carbamate Openeye Name: [4-methoxy-2-(4-methylpiperazin-1-yl)-1,3-benzothiazol-7-yl] N-(4-cyano-2-methyl-pyrazol-3-yl)carbamate CAS Name: N-(4-cyano-2-methyl-3-pyrazolyl)carbamic acid [4-methoxy-2-(4-methyl-1-piperazinyl)-1,3-benzothiazol-7-yl] ester IUPAC Name: [4-methoxy-2-(4-methylpiperazin-1-yl)-1,3-benzothiazol-7-yl] N-(4-cyano-2-methylpyrazol-3-yl)carbamate Traditional Name: N-(4-cyano-2-methyl-pyrazol-3-yl)carbamic acid [4-methoxy-2-(4-methylpiperazino)-1,3-benzothiazol-7-yl] ester Formula: C19H21N7O3S MolecularWeight: 427.48014

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=C(C=CC(=C3S2)OC(=O)NC4=C(C=NN4C)C#N)OC

Isomeric SMILES

CN1CCN(CC1)C2=NC3=C(C=CC(=C3S2)OC(=O)NC4=C(C=NN4C)C#N)OC

InChI

InChI=1S/C19H21N7O3S/c1-24-6-8-26(9-7-24)18-22-15-13(28-3)4-5-14(16(15)30-18)29-19(27)23-17-12(10-20)11-21-25(17)2/h4-5,11H,6-9H2,1-3H3,(H,23,27)