[5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-yl-methanone

Systemtic Name: [5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-yl-methanone Openeye Name: [5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone CAS Name: [5-[4-(2,3-dimethylphenyl)-1-piperazinyl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone IUPAC Name: [5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholin-4-ylmethanone Traditional Name: [5-[4-(2,3-dimethylphenyl)piperazino]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone Formula: C25H35N5OS MolecularWeight: 453.6433

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C3CCC4=C(C3)C(=NN4C)C(=O)N5CCSCC5)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C3CCC4=C(C3)C(=NN4C)C(=O)N5CCSCC5)C

InChI

InChI=1S/C25H35N5OS/c1-18-5-4-6-22(19(18)2)29-11-9-28(10-12-29)20-7-8-23-21(17-20)24(26-27(23)3)25(31)30-13-15-32-16-14-30/h4-6,20H,7-17H2,1-3H3