[1-prop-2-enyl-5-(3-pyridin-4-ylpropylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-yl-methanone

Systemtic Name: [1-prop-2-enyl-5-(3-pyridin-4-ylpropylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-yl-methanone Openeye Name: [1-allyl-5-[3-(4-pyridyl)propylamino]-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone CAS Name: [1-prop-2-enyl-5-(3-pyridin-4-ylpropylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone IUPAC Name: [1-prop-2-enyl-5-(3-pyridin-4-ylpropylamino)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone Traditional Name: [1-allyl-5-[3-(4-pyridyl)propylamino]-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone Formula: C23H31N5OS MolecularWeight: 425.59014

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(CC(CC2)NCCCC3=CC=NC=C3)C(=N1)C(=O)N4CCSCC4

Isomeric SMILES

C=CCN1C2=C(CC(CC2)NCCCC3=CC=NC=C3)C(=N1)C(=O)N4CCSCC4

InChI

InChI=1S/C23H31N5OS/c1-2-12-28-21-6-5-19(25-9-3-4-18-7-10-24-11-8-18)17-20(21)22(26-28)23(29)27-13-15-30-16-14-27/h2,7-8,10-11,19,25H,1,3-6,9,12-17H2