[1-propyl-5-(pyridin-2-ylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-yl-methanone

Systemtic Name: [1-propyl-5-(pyridin-2-ylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-yl-methanone Openeye Name: [1-propyl-5-(2-pyridylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone CAS Name: [1-propyl-5-(2-pyridinylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone IUPAC Name: [1-propyl-5-(pyridin-2-ylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone Traditional Name: [1-propyl-5-(2-pyridylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone Formula: C21H29N5OS MolecularWeight: 399.55286

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(CC(CC2)NCC3=CC=CC=N3)C(=N1)C(=O)N4CCSCC4

Isomeric SMILES

CCCN1C2=C(CC(CC2)NCC3=CC=CC=N3)C(=N1)C(=O)N4CCSCC4

InChI

InChI=1S/C21H29N5OS/c1-2-9-26-19-7-6-16(23-15-17-5-3-4-8-22-17)14-18(19)20(24-26)21(27)25-10-12-28-13-11-25/h3-5,8,16,23H,2,6-7,9-15H2,1H3