(propan-2-ylcarbamoylamino) 4-[(3-methylphenyl)amino]pyridine-3-sulfinate

Systemtic Name: (propan-2-ylcarbamoylamino) 4-[(3-methylphenyl)amino]pyridine-3-sulfinate Openeye Name: (isopropylcarbamoylamino) 4-(3-methylanilino)pyridine-3-sulfinate CAS Name: 4-(3-methylanilino)-3-pyridinesulfinic acid [[oxo-(propan-2-ylamino)methyl]amino] ester IUPAC Name: (propan-2-ylcarbamoylamino) 4-(3-methylanilino)pyridine-3-sulfinate Traditional Name: 4-(m-toluidino)pyridine-3-sulfinic acid (isopropylcarbamoylamino) ester Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=C(C=NC=C2)S(=O)ONC(=O)NC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=C(C=NC=C2)S(=O)ONC(=O)NC(C)C

InChI

InChI=1S/C16H20N4O3S/c1-11(2)18-16(21)20-23-24(22)15-10-17-8-7-14(15)19-13-6-4-5-12(3)9-13/h4-11H,1-3H3,(H,17,19)(H2,18,20,21)