1-[4-[[(2-methyl-5-nitro-phenyl)sulfonylamino]methyl]phenyl]-3-propan-2-yl-urea

Systemtic Name: 1-[4-[[(2-methyl-5-nitro-phenyl)sulfonylamino]methyl]phenyl]-3-propan-2-yl-urea Openeye Name: 1-isopropyl-3-[4-[[(2-methyl-5-nitro-phenyl)sulfonylamino]methyl]phenyl]urea CAS Name: 1-[4-[[(2-methyl-5-nitrophenyl)sulfonylamino]methyl]phenyl]-3-propan-2-ylurea IUPAC Name: 1-[4-[[(2-methyl-5-nitrophenyl)sulfonylamino]methyl]phenyl]-3-propan-2-ylurea Traditional Name: 1-isopropyl-3-[4-[[(2-methyl-5-nitro-phenyl)sulfonylamino]methyl]phenyl]urea Formula: C18H22N4O5S MolecularWeight: 406.45608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC2=CC=C(C=C2)NC(=O)NC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC2=CC=C(C=C2)NC(=O)NC(C)C

InChI

InChI=1S/C18H22N4O5S/c1-12(2)20-18(23)21-15-7-5-14(6-8-15)11-19-28(26,27)17-10-16(22(24)25)9-4-13(17)3/h4-10,12,19H,11H2,1-3H3,(H2,20,21,23)