methanesulfonic acid; 6-(5-methoxy-1-methyl-indol-3-yl)-5H-pyrrolo[2,3-b]pyrazine

Systemtic Name: methanesulfonic acid; 6-(5-methoxy-1-methyl-indol-3-yl)-5H-pyrrolo[2,3-b]pyrazine Openeye Name: methanesulfonic acid; 6-(5-methoxy-1-methyl-indol-3-yl)-5H-pyrrolo[2,3-b]pyrazine CAS Name: methanesulfonic acid; 6-(5-methoxy-1-methyl-3-indolyl)-5H-pyrrolo[2,3-b]pyrazine IUPAC Name: methanesulfonic acid; 6-(5-methoxy-1-methylindol-3-yl)-5H-pyrrolo[2,3-b]pyrazine Traditional Name: mesylic acid; 6-(5-methoxy-1-methyl-indol-3-yl)-5H-pyrrolo[2,3-b]pyrazine Formula: C17H18N4O4S MolecularWeight: 374.41422

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)OC)C3=CC4=NC=CN=C4N3.CS(=O)(=O)O

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)OC)C3=CC4=NC=CN=C4N3.CS(=O)(=O)O

InChI

InChI=1S/C16H14N4O.CH4O3S/c1-20-9-12(11-7-10(21-2)3-4-15(11)20)13-8-14-16(19-13)18-6-5-17-14;1-5(2,3)4/h3-9H,1-2H3,(H,18,19);1H3,(H,2,3,4)