(5-nitro-1-benzothiophen-2-yl)-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: (5-nitro-1-benzothiophen-2-yl)-(4-phenylpiperazin-1-yl)methanone Openeye Name: (5-nitrobenzothiophen-2-yl)-(4-phenylpiperazin-1-yl)methanone CAS Name: (5-nitro-1-benzothiophen-2-yl)-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (5-nitro-1-benzothiophen-2-yl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: (5-nitrobenzothiophen-2-yl)-(4-phenylpiperazino)methanone Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O3S/c23-19(18-13-14-12-16(22(24)25)6-7-17(14)26-18)21-10-8-20(9-11-21)15-4-2-1-3-5-15/h1-7,12-13H,8-11H2