1-methyl-1-[2-[(3-methylphenyl)amino]-5-nitro-phenyl]sulfonyl-3-propan-2-yl-urea

Systemtic Name: 1-methyl-1-[2-[(3-methylphenyl)amino]-5-nitro-phenyl]sulfonyl-3-propan-2-yl-urea Openeye Name: 3-isopropyl-1-methyl-1-[2-(3-methylanilino)-5-nitro-phenyl]sulfonyl-urea CAS Name: 1-methyl-1-[2-(3-methylanilino)-5-nitrophenyl]sulfonyl-3-propan-2-ylurea IUPAC Name: 1-methyl-1-[2-(3-methylanilino)-5-nitrophenyl]sulfonyl-3-propan-2-ylurea Traditional Name: 3-isopropyl-1-methyl-1-[2-(m-toluidino)-5-nitro-phenyl]sulfonyl-urea Formula: C18H22N4O5S MolecularWeight: 406.45608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N(C)C(=O)NC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N(C)C(=O)NC(C)C

InChI

InChI=1S/C18H22N4O5S/c1-12(2)19-18(23)21(4)28(26,27)17-11-15(22(24)25)8-9-16(17)20-14-7-5-6-13(3)10-14/h5-12,20H,1-4H3,(H,19,23)