1-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea

Systemtic Name: 1-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Openeye Name: 1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-[4-(4-nitrophenyl)thiazol-2-yl]urea CAS Name: 1-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]-3-[4-(4-nitrophenyl)-2-thiazolyl]urea IUPAC Name: 1-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Traditional Name: 1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-[4-(4-nitrophenyl)thiazol-2-yl]urea Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O3S/c1-14(2)16-6-5-7-17(12-16)22(3,4)25-20(27)24-21-23-19(13-30-21)15-8-10-18(11-9-15)26(28)29/h5-13H,1H2,2-4H3,(H2,23,24,25,27)