2-methoxyethyl-methyl-[(5S)-1-methyl-3-(thiophen-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: 2-methoxyethyl-methyl-[(5S)-1-methyl-3-(thiophen-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: 2-methoxyethyl-methyl-[(5S)-1-methyl-3-(2-thienylmethylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: 2-methoxyethyl-methyl-[(5S)-1-methyl-3-[oxo-(thiophen-2-ylmethylamino)methyl]-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: 2-methoxyethyl-methyl-[(5S)-1-methyl-3-(thiophen-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: 2-methoxyethyl-methyl-[(5S)-1-methyl-3-(2-thenylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C18H27N4O2S+ MolecularWeight: 363.49758

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)[NH+](C)CCOC)C(=N1)C(=O)NCC3=CC=CS3

Isomeric SMILES

CN1C2=C(C[C@H](CC2)[NH+](C)CCOC)C(=N1)C(=O)NCC3=CC=CS3

InChI

InChI=1S/C18H26N4O2S/c1-21(8-9-24-3)13-6-7-16-15(11-13)17(20-22(16)2)18(23)19-12-14-5-4-10-25-14/h4-5,10,13H,6-9,11-12H2,1-3H3,(H,19,23)/p+1/t13-/m0/s1