1,3-bis(3-isocyanato-4-methyl-phenyl)-1-[(3-isocyanato-4-methyl-phenyl)carbamoyl]urea

Systemtic Name: 1,3-bis(3-isocyanato-4-methyl-phenyl)-1-[(3-isocyanato-4-methyl-phenyl)carbamoyl]urea Openeye Name: 1,3-bis(3-isocyanato-4-methyl-phenyl)-1-[(3-isocyanato-4-methyl-phenyl)carbamoyl]urea CAS Name: 1-[(3-isocyanato-4-methylanilino)-oxomethyl]-1,3-bis(3-isocyanato-4-methylphenyl)urea IUPAC Name: 1,3-bis(3-isocyanato-4-methylphenyl)-1-[(3-isocyanato-4-methylphenyl)carbamoyl]urea Traditional Name: 1,3-bis(3-isocyanato-4-methyl-phenyl)-1-[(3-isocyanato-4-methyl-phenyl)carbamoyl]urea Formula: C26H20N6O5 MolecularWeight: 496.4742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N(C2=CC(=C(C=C2)C)N=C=O)C(=O)NC3=CC(=C(C=C3)C)N=C=O)N=C=O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N(C2=CC(=C(C=C2)C)N=C=O)C(=O)NC3=CC(=C(C=C3)C)N=C=O)N=C=O

InChI

InChI=1S/C26H20N6O5/c1-16-4-7-19(10-22(16)27-13-33)30-25(36)32(21-9-6-18(3)24(12-21)29-15-35)26(37)31-20-8-5-17(2)23(11-20)28-14-34/h4-12H,1-3H3,(H,30,36)(H,31,37)