[(3S)-3-butyl-4-ethenylsulfonyl-piperazin-1-yl]-naphthalen-1-yl-methanone

Systemtic Name: [(3S)-3-butyl-4-ethenylsulfonyl-piperazin-1-yl]-naphthalen-1-yl-methanone Openeye Name: [(3S)-3-butyl-4-vinylsulfonyl-piperazin-1-yl]-(1-naphthyl)methanone CAS Name: [(3S)-3-butyl-4-ethenylsulfonyl-1-piperazinyl]-(1-naphthalenyl)methanone IUPAC Name: [(3S)-3-butyl-4-ethenylsulfonylpiperazin-1-yl]-naphthalen-1-ylmethanone Traditional Name: [(3S)-3-butyl-4-vinylsulfonyl-piperazino]-(1-naphthyl)methanone Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CCN1S(=O)(=O)C=C)C(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCCC[C@H]1CN(CCN1S(=O)(=O)C=C)C(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H26N2O3S/c1-3-5-11-18-16-22(14-15-23(18)27(25,26)4-2)21(24)20-13-8-10-17-9-6-7-12-19(17)20/h4,6-10,12-13,18H,2-3,5,11,14-16H2,1H3/t18-/m0/s1