1-[(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)amino]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea

Systemtic Name: 1-[(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)amino]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Openeye Name: 1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-(4-morpholinosulfonyl-2-nitro-anilino)urea CAS Name: 1-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]-3-[4-(4-morpholinylsulfonyl)-2-nitroanilino]urea IUPAC Name: 1-(4-morpholin-4-ylsulfonyl-2-nitroanilino)-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Traditional Name: 1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-(4-morpholinosulfonyl-2-nitro-anilino)urea Formula: C23H29N5O6S MolecularWeight: 503.57126

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NNC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NNC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C23H29N5O6S/c1-16(2)17-6-5-7-18(14-17)23(3,4)24-22(29)26-25-20-9-8-19(15-21(20)28(30)31)35(32,33)27-10-12-34-13-11-27/h5-9,14-15,25H,1,10-13H2,2-4H3,(H2,24,26,29)