1-[2,6-di(propan-2-yl)phenyl]-3-[4-(5-nitropyridin-2-yl)sulfanylphenyl]urea

Systemtic Name: 1-[2,6-di(propan-2-yl)phenyl]-3-[4-(5-nitropyridin-2-yl)sulfanylphenyl]urea Openeye Name: 1-(2,6-diisopropylphenyl)-3-[4-[(5-nitro-2-pyridyl)sulfanyl]phenyl]urea CAS Name: 1-[2,6-di(propan-2-yl)phenyl]-3-[4-[(5-nitro-2-pyridinyl)thio]phenyl]urea IUPAC Name: 1-[2,6-di(propan-2-yl)phenyl]-3-[4-(5-nitropyridin-2-yl)sulfanylphenyl]urea Traditional Name: 1-(2,6-diisopropylphenyl)-3-[4-[(5-nitro-2-pyridyl)thio]phenyl]urea Formula: C24H26N4O3S MolecularWeight: 450.55324

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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=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C24H26N4O3S/c1-15(2)20-6-5-7-21(16(3)4)23(20)27-24(29)26-17-8-11-19(12-9-17)32-22-13-10-18(14-25-22)28(30)31/h5-16H,1-4H3,(H2,26,27,29)