[5-(2,2-diphenylethylamino)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-yl-methanone

Systemtic Name: [5-(2,2-diphenylethylamino)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-yl-methanone Openeye Name: [5-(2,2-diphenylethylamino)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone CAS Name: [5-(2,2-diphenylethylamino)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone IUPAC Name: [5-(2,2-diphenylethylamino)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone Traditional Name: [5-(2,2-diphenylethylamino)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone Formula: C27H32N4OS MolecularWeight: 460.63418

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)NCC(C3=CC=CC=C3)C4=CC=CC=C4)C(=N1)C(=O)N5CCSCC5

Isomeric SMILES

CN1C2=C(CC(CC2)NCC(C3=CC=CC=C3)C4=CC=CC=C4)C(=N1)C(=O)N5CCSCC5

InChI

InChI=1S/C27H32N4OS/c1-30-25-13-12-22(18-23(25)26(29-30)27(32)31-14-16-33-17-15-31)28-19-24(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-11,22,24,28H,12-19H2,1H3