1-butan-2-yl-3-[2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-5-yl]urea

Systemtic Name: 1-butan-2-yl-3-[2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-5-yl]urea Openeye Name: 1-[2-(p-tolylsulfonylamino)-1,3-benzothiazol-5-yl]-3-sec-butyl-urea CAS Name: 1-butan-2-yl-3-[2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-5-yl]urea IUPAC Name: 1-butan-2-yl-3-[2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-5-yl]urea Traditional Name: 1-sec-butyl-3-[2-(tosylamino)-1,3-benzothiazol-5-yl]urea Formula: C19H22N4O3S2 MolecularWeight: 418.53298

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC1=CC2=C(C=C1)SC(=N2)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(C)NC(=O)NC1=CC2=C(C=C1)SC(=N2)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H22N4O3S2/c1-4-13(3)20-18(24)21-14-7-10-17-16(11-14)22-19(27-17)23-28(25,26)15-8-5-12(2)6-9-15/h5-11,13H,4H2,1-3H3,(H,22,23)(H2,20,21,24)