1-(2,1,3-benzothiadiazol-4-yl)-3-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]urea

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-yl)-3-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]urea Openeye Name: 1-(2,1,3-benzothiadiazol-4-yl)-3-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]urea CAS Name: 1-(2,1,3-benzothiadiazol-4-yl)-3-[4-methoxy-3-(4-methyl-1-piperazinyl)phenyl]urea IUPAC Name: 1-(2,1,3-benzothiadiazol-4-yl)-3-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]urea Traditional Name: 1-[4-methoxy-3-(4-methylpiperazino)phenyl]-3-piazthiol-4-yl-urea Formula: C19H22N6O2S MolecularWeight: 398.48198

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=CC(=C2)NC(=O)NC3=CC=CC4=NSN=C43)OC

Isomeric SMILES

CN1CCN(CC1)C2=C(C=CC(=C2)NC(=O)NC3=CC=CC4=NSN=C43)OC

InChI

InChI=1S/C19H22N6O2S/c1-24-8-10-25(11-9-24)16-12-13(6-7-17(16)27-2)20-19(26)21-14-4-3-5-15-18(14)23-28-22-15/h3-7,12H,8-11H2,1-2H3,(H2,20,21,26)