1-(azepan-1-yl)-2-[4-[4,5-bis(bromanyl)thiophen-2-yl]carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[4-[4,5-bis(bromanyl)thiophen-2-yl]carbonylpiperazin-1-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[4-(4,5-dibromothiophene-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[4-[(4,5-dibromo-2-thiophenyl)-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[4-(4,5-dibromothiophene-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[4-(4,5-dibromothiophene-2-carbonyl)piperazino]ethanone Formula: C17H23Br2N3O2S MolecularWeight: 493.25642

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2CCN(CC2)C(=O)C3=CC(=C(S3)Br)Br

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2CCN(CC2)C(=O)C3=CC(=C(S3)Br)Br

InChI

InChI=1S/C17H23Br2N3O2S/c18-13-11-14(25-16(13)19)17(24)22-9-7-20(8-10-22)12-15(23)21-5-3-1-2-4-6-21/h11H,1-10,12H2