4-chloranyl-2-(1H-indol-2-ylcarbamoylamino)-5-methyl-benzenesulfonic acid

Systemtic Name: 4-chloranyl-2-(1H-indol-2-ylcarbamoylamino)-5-methyl-benzenesulfonic acid Openeye Name: 4-chloro-2-(1H-indol-2-ylcarbamoylamino)-5-methyl-benzenesulfonic acid CAS Name: 4-chloro-2-[[(1H-indol-2-ylamino)-oxomethyl]amino]-5-methylbenzenesulfonic acid IUPAC Name: 4-chloro-2-(1H-indol-2-ylcarbamoylamino)-5-methylbenzenesulfonic acid Traditional Name: 4-chloro-2-(1H-indol-2-ylcarbamoylamino)-5-methyl-besylic acid Formula: C16H14ClN3O4S MolecularWeight: 379.81806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)NC(=O)NC2=CC3=CC=CC=C3N2)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)NC(=O)NC2=CC3=CC=CC=C3N2)S(=O)(=O)O

InChI

InChI=1S/C16H14ClN3O4S/c1-9-6-14(25(22,23)24)13(8-11(9)17)19-16(21)20-15-7-10-4-2-3-5-12(10)18-15/h2-8,18H,1H3,(H2,19,20,21)(H,22,23,24)