methyl-[(5S)-1-methyl-3-pyrrolidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-(thiophen-3-ylmethyl)azanium

Systemtic Name: methyl-[(5S)-1-methyl-3-pyrrolidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-(thiophen-3-ylmethyl)azanium Openeye Name: methyl-[(5S)-1-methyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(3-thienylmethyl)ammonium CAS Name: methyl-[(5S)-1-methyl-3-[oxo(1-pyrrolidinyl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]-(3-thiophenylmethyl)ammonium IUPAC Name: methyl-[(5S)-1-methyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(thiophen-3-ylmethyl)azanium Traditional Name: methyl-[(5S)-1-methyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(3-thenyl)ammonium Formula: C19H27N4OS+ MolecularWeight: 359.50888

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)[NH+](C)CC3=CSC=C3)C(=N1)C(=O)N4CCCC4

Isomeric SMILES

CN1C2=C(C[C@H](CC2)[NH+](C)CC3=CSC=C3)C(=N1)C(=O)N4CCCC4

InChI

InChI=1S/C19H26N4OS/c1-21(12-14-7-10-25-13-14)15-5-6-17-16(11-15)18(20-22(17)2)19(24)23-8-3-4-9-23/h7,10,13,15H,3-6,8-9,11-12H2,1-2H3/p+1/t15-/m0/s1