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

Systemtic Name: (2-methoxynaphthalen-1-yl)methyl-[(5S)-1-methyl-3-thiomorpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: (2-methoxy-1-naphthyl)methyl-[(5S)-1-methyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: (2-methoxy-1-naphthalenyl)methyl-[(5S)-1-methyl-3-[oxo(thiomorpholin-4-yl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: (2-methoxynaphthalen-1-yl)methyl-[(5S)-1-methyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: (2-methoxy-1-naphthyl)methyl-[(5S)-1-methyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C25H31N4O2S+ MolecularWeight: 451.60424

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)[NH2+]CC3=C(C=CC4=CC=CC=C43)OC)C(=N1)C(=O)N5CCSCC5

Isomeric SMILES

CN1C2=C(C[C@H](CC2)[NH2+]CC3=C(C=CC4=CC=CC=C43)OC)C(=N1)C(=O)N5CCSCC5

InChI

InChI=1S/C25H30N4O2S/c1-28-22-9-8-18(15-20(22)24(27-28)25(30)29-11-13-32-14-12-29)26-16-21-19-6-4-3-5-17(19)7-10-23(21)31-2/h3-7,10,18,26H,8-9,11-16H2,1-2H3/p+1/t18-/m0/s1