[1-ethyl-5-[(phenylmethyl)amino]-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-yl-methanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)NCC3=CC=CC=C3)C(=N1)C(=O)N4CCSCC4

Isomeric SMILES

CCN1C2=C(CC(CC2)NCC3=CC=CC=C3)C(=N1)C(=O)N4CCSCC4

InChI

InChI=1S/C21H28N4OS/c1-2-25-19-9-8-17(22-15-16-6-4-3-5-7-16)14-18(19)20(23-25)21(26)24-10-12-27-13-11-24/h3-7,17,22H,2,8-15H2,1H3