1-[4-[(3-methylphenyl)amino]pyridin-3-yl]sulfonyl-3-propan-2-yl-urea hydrochloride

Systemtic Name: 1-[4-[(3-methylphenyl)amino]pyridin-3-yl]sulfonyl-3-propan-2-yl-urea hydrochloride Openeye Name: 1-isopropyl-3-[[4-(3-methylanilino)-3-pyridyl]sulfonyl]urea hydrochloride CAS Name: 1-[[4-(3-methylanilino)-3-pyridinyl]sulfonyl]-3-propan-2-ylurea hydrochloride IUPAC Name: 1-[4-(3-methylanilino)pyridin-3-yl]sulfonyl-3-propan-2-ylurea hydrochloride Traditional Name: 1-isopropyl-3-[[4-(m-toluidino)-3-pyridyl]sulfonyl]urea hydrochloride Formula: C16H21ClN4O3S MolecularWeight: 384.88094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O3S.ClH/c1-11(2)18-16(21)20-24(22,23)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);1H