furan-2-ylmethyl-[(5R)-1-propyl-3-thiomorpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: furan-2-ylmethyl-[(5R)-1-propyl-3-thiomorpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: 2-furylmethyl-[(5R)-1-propyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: 2-furanylmethyl-[(5R)-3-[oxo(thiomorpholin-4-yl)methyl]-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: furan-2-ylmethyl-[(5R)-1-propyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: 2-furfuryl-[(5R)-1-propyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C20H29N4O2S+ MolecularWeight: 389.53486

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(CC(CC2)[NH2+]CC3=CC=CO3)C(=N1)C(=O)N4CCSCC4

Isomeric SMILES

CCCN1C2=C(C[C@@H](CC2)[NH2+]CC3=CC=CO3)C(=N1)C(=O)N4CCSCC4

InChI

InChI=1S/C20H28N4O2S/c1-2-7-24-18-6-5-15(21-14-16-4-3-10-26-16)13-17(18)19(22-24)20(25)23-8-11-27-12-9-23/h3-4,10,15,21H,2,5-9,11-14H2,1H3/p+1/t15-/m1/s1