1-[[1-(3-iodanylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-(2-methylphenyl)urea

Systemtic Name: 1-[[1-(3-iodanylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-(2-methylphenyl)urea Openeye Name: 1-[[1-(3-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-(o-tolyl)urea CAS Name: 1-[[1-(3-iodophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-3-(2-methylphenyl)urea IUPAC Name: 1-[[1-(3-iodophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-3-(2-methylphenyl)urea Traditional Name: 1-[[1-(3-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-(o-tolyl)urea Formula: C21H21IN4O MolecularWeight: 472.32211

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NN=CC2=C(N(C(=C2)C)C3=CC(=CC=C3)I)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NN=CC2=C(N(C(=C2)C)C3=CC(=CC=C3)I)C

InChI

InChI=1S/C21H21IN4O/c1-14-7-4-5-10-20(14)24-21(27)25-23-13-17-11-15(2)26(16(17)3)19-9-6-8-18(22)12-19/h4-13H,1-3H3,(H2,24,25,27)