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

Systemtic Name: [1-propyl-5-(2-pyridin-3-ylethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-yl-methanone Openeye Name: [1-propyl-5-[2-(3-pyridyl)ethylamino]-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone CAS Name: [1-propyl-5-[2-(3-pyridinyl)ethylamino]-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone IUPAC Name: [1-propyl-5-(2-pyridin-3-ylethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone Traditional Name: [1-propyl-5-[2-(3-pyridyl)ethylamino]-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone Formula: C22H31N5OS MolecularWeight: 413.57944

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(CC(CC2)NCCC3=CN=CC=C3)C(=N1)C(=O)N4CCSCC4

Isomeric SMILES

CCCN1C2=C(CC(CC2)NCCC3=CN=CC=C3)C(=N1)C(=O)N4CCSCC4

InChI

InChI=1S/C22H31N5OS/c1-2-10-27-20-6-5-18(24-9-7-17-4-3-8-23-16-17)15-19(20)21(25-27)22(28)26-11-13-29-14-12-26/h3-4,8,16,18,24H,2,5-7,9-15H2,1H3