1-[2,6-di(propan-2-yl)phenyl]-3-[4-(2-nitrophenyl)sulfanylphenyl]urea

Systemtic Name: 1-[2,6-di(propan-2-yl)phenyl]-3-[4-(2-nitrophenyl)sulfanylphenyl]urea Openeye Name: 1-(2,6-diisopropylphenyl)-3-[4-(2-nitrophenyl)sulfanylphenyl]urea CAS Name: 1-[2,6-di(propan-2-yl)phenyl]-3-[4-[(2-nitrophenyl)thio]phenyl]urea IUPAC Name: 1-[2,6-di(propan-2-yl)phenyl]-3-[4-(2-nitrophenyl)sulfanylphenyl]urea Traditional Name: 1-(2,6-diisopropylphenyl)-3-[4-[(2-nitrophenyl)thio]phenyl]urea Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)NC2=CC=C(C=C2)SC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)NC2=CC=C(C=C2)SC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C25H27N3O3S/c1-16(2)20-8-7-9-21(17(3)4)24(20)27-25(29)26-18-12-14-19(15-13-18)32-23-11-6-5-10-22(23)28(30)31/h5-17H,1-4H3,(H2,26,27,29)