1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-sulfamoylphenyl)thiourea

Systemtic Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-sulfamoylphenyl)thiourea Openeye Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-sulfamoylphenyl)thiourea CAS Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-sulfamoylphenyl)thiourea IUPAC Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-sulfamoylphenyl)thiourea Traditional Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-sulfamoylphenyl)thiourea Formula: C16H16N4O2S3 MolecularWeight: 392.51884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C16H16N4O2S3/c1-9-7-13-14(8-10(9)2)24-16(19-13)20-15(23)18-11-3-5-12(6-4-11)25(17,21)22/h3-8H,1-2H3,(H2,17,21,22)(H2,18,19,20,23)