diethyl-[(5S)-1-methyl-3-thiomorpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: diethyl-[(5S)-1-methyl-3-thiomorpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: diethyl-[(5S)-1-methyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: diethyl-[(5S)-1-methyl-3-[oxo(thiomorpholin-4-yl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: diethyl-[(5S)-1-methyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: diethyl-[(5S)-1-methyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C17H29N4OS+ MolecularWeight: 337.50336

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C1CCC2=C(C1)C(=NN2C)C(=O)N3CCSCC3

Isomeric SMILES

CC[NH+](CC)[C@H]1CCC2=C(C1)C(=NN2C)C(=O)N3CCSCC3

InChI

InChI=1S/C17H28N4OS/c1-4-20(5-2)13-6-7-15-14(12-13)16(18-19(15)3)17(22)21-8-10-23-11-9-21/h13H,4-12H2,1-3H3/p+1/t13-/m0/s1