1-[(3-azanyl-1H-indazol-6-yl)methyl]-4-[(6-chloranyl-1-benzothiophen-2-yl)methyl]piperazin-2-one

Systemtic Name: 1-[(3-azanyl-1H-indazol-6-yl)methyl]-4-[(6-chloranyl-1-benzothiophen-2-yl)methyl]piperazin-2-one Openeye Name: 1-[(3-amino-1H-indazol-6-yl)methyl]-4-[(6-chlorobenzothiophen-2-yl)methyl]piperazin-2-one CAS Name: 1-[(3-amino-1H-indazol-6-yl)methyl]-4-[(6-chloro-1-benzothiophen-2-yl)methyl]-2-piperazinone IUPAC Name: 1-[(3-amino-1H-indazol-6-yl)methyl]-4-[(6-chloro-1-benzothiophen-2-yl)methyl]piperazin-2-one Traditional Name: 1-[(3-amino-1H-indazol-6-yl)methyl]-4-[(6-chlorobenzothiophen-2-yl)methyl]piperazin-2-one Formula: C21H20ClN5OS MolecularWeight: 425.9344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1CC2=CC3=C(S2)C=C(C=C3)Cl)CC4=CC5=C(C=C4)C(=NN5)N

Isomeric SMILES

C1CN(C(=O)CN1CC2=CC3=C(S2)C=C(C=C3)Cl)CC4=CC5=C(C=C4)C(=NN5)N

InChI

InChI=1S/C21H20ClN5OS/c22-15-3-2-14-8-16(29-19(14)9-15)11-26-5-6-27(20(28)12-26)10-13-1-4-17-18(7-13)24-25-21(17)23/h1-4,7-9H,5-6,10-12H2,(H3,23,24,25)