(5-chloranylthiophen-2-yl)methyl-[(5R)-1-propyl-3-pyrrolidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[(5R)-1-propyl-3-pyrrolidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: (5-chloro-2-thienyl)methyl-[(5R)-1-propyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-[(5R)-3-[oxo(1-pyrrolidinyl)methyl]-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-[(5R)-1-propyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: (5-chloro-2-thienyl)methyl-[(5R)-1-propyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C20H28ClN4OS+ MolecularWeight: 407.98052

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(CC(CC2)[NH2+]CC3=CC=C(S3)Cl)C(=N1)C(=O)N4CCCC4

Isomeric SMILES

CCCN1C2=C(C[C@@H](CC2)[NH2+]CC3=CC=C(S3)Cl)C(=N1)C(=O)N4CCCC4

InChI

InChI=1S/C20H27ClN4OS/c1-2-9-25-17-7-5-14(22-13-15-6-8-18(21)27-15)12-16(17)19(23-25)20(26)24-10-3-4-11-24/h6,8,14,22H,2-5,7,9-13H2,1H3/p+1/t14-/m1/s1