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

Systemtic Name: [5-(azocan-1-yl)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-yl-methanone Openeye Name: [1-allyl-5-(azocan-1-yl)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone CAS Name: [5-(1-azocanyl)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone IUPAC Name: [5-(azocan-1-yl)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone Traditional Name: [1-allyl-5-(azocan-1-yl)-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone Formula: C22H34N4OS MolecularWeight: 402.59656

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(CC(CC2)N3CCCCCCC3)C(=N1)C(=O)N4CCSCC4

Isomeric SMILES

C=CCN1C2=C(CC(CC2)N3CCCCCCC3)C(=N1)C(=O)N4CCSCC4

InChI

InChI=1S/C22H34N4OS/c1-2-10-26-20-9-8-18(24-11-6-4-3-5-7-12-24)17-19(20)21(23-26)22(27)25-13-15-28-16-14-25/h2,18H,1,3-17H2