[2-chloranyl-4-[(2-methyl-1,5-naphthyridin-4-yl)carbamoylamino]phenyl] methanesulfonate

Systemtic Name: [2-chloranyl-4-[(2-methyl-1,5-naphthyridin-4-yl)carbamoylamino]phenyl] methanesulfonate Openeye Name: [2-chloro-4-[(2-methyl-1,5-naphthyridin-4-yl)carbamoylamino]phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-chloro-4-[[[(2-methyl-1,5-naphthyridin-4-yl)amino]-oxomethyl]amino]phenyl] ester IUPAC Name: [2-chloro-4-[(2-methyl-1,5-naphthyridin-4-yl)carbamoylamino]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-chloro-4-[(2-methyl-1,5-naphthyridin-4-yl)carbamoylamino]phenyl] ester Formula: C17H15ClN4O4S MolecularWeight: 406.8434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C1)NC(=O)NC3=CC(=C(C=C3)OS(=O)(=O)C)Cl)N=CC=C2

Isomeric SMILES

CC1=NC2=C(C(=C1)NC(=O)NC3=CC(=C(C=C3)OS(=O)(=O)C)Cl)N=CC=C2

InChI

InChI=1S/C17H15ClN4O4S/c1-10-8-14(16-13(20-10)4-3-7-19-16)22-17(23)21-11-5-6-15(12(18)9-11)26-27(2,24)25/h3-9H,1-2H3,(H2,20,21,22,23)