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

Systemtic Name: [1-methyl-5-(phenethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-yl-methanone Openeye Name: [1-methyl-5-(phenethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone CAS Name: [1-methyl-5-(phenethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone IUPAC Name: [1-methyl-5-(phenethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone Traditional Name: [1-methyl-5-(phenethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone Formula: C21H28N4OS MolecularWeight: 384.53822

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)NCCC3=CC=CC=C3)C(=N1)C(=O)N4CCSCC4

Isomeric SMILES

CN1C2=C(CC(CC2)NCCC3=CC=CC=C3)C(=N1)C(=O)N4CCSCC4

InChI

InChI=1S/C21H28N4OS/c1-24-19-8-7-17(22-10-9-16-5-3-2-4-6-16)15-18(19)20(23-24)21(26)25-11-13-27-14-12-25/h2-6,17,22H,7-15H2,1H3