3-[5-azanyl-4-(3-iodanylphenyl)carbonyl-pyrazol-1-yl]-N-methoxy-4-methyl-benzamide

Systemtic Name: 3-[5-azanyl-4-(3-iodanylphenyl)carbonyl-pyrazol-1-yl]-N-methoxy-4-methyl-benzamide Openeye Name: 3-[5-amino-4-(3-iodobenzoyl)pyrazol-1-yl]-N-methoxy-4-methyl-benzamide CAS Name: 3-[5-amino-4-[(3-iodophenyl)-oxomethyl]-1-pyrazolyl]-N-methoxy-4-methylbenzamide IUPAC Name: 3-[5-amino-4-(3-iodobenzoyl)pyrazol-1-yl]-N-methoxy-4-methylbenzamide Traditional Name: 3-[5-amino-4-(3-iodobenzoyl)pyrazol-1-yl]-N-methoxy-4-methyl-benzamide Formula: C19H17IN4O3 MolecularWeight: 476.26775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NOC)N2C(=C(C=N2)C(=O)C3=CC(=CC=C3)I)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NOC)N2C(=C(C=N2)C(=O)C3=CC(=CC=C3)I)N

InChI

InChI=1S/C19H17IN4O3/c1-11-6-7-13(19(26)23-27-2)9-16(11)24-18(21)15(10-22-24)17(25)12-4-3-5-14(20)8-12/h3-10H,21H2,1-2H3,(H,23,26)