S-piperidin-1-yl 4-azanyl-2-butoxy-benzenecarbothioate

Systemtic Name: S-piperidin-1-yl 4-azanyl-2-butoxy-benzenecarbothioate Openeye Name: S-(1-piperidyl) 4-amino-2-butoxy-benzenecarbothioate CAS Name: 4-amino-2-butoxybenzenecarbothioic acid S-(1-piperidinyl) ester IUPAC Name: S-piperidin-1-yl 4-amino-2-butoxybenzenecarbothioate Traditional Name: 4-amino-2-butoxy-thiobenzoic acid S-piperidino ester Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)N)C(=O)SN2CCCCC2

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)N)C(=O)SN2CCCCC2

InChI

InChI=1S/C16H24N2O2S/c1-2-3-11-20-15-12-13(17)7-8-14(15)16(19)21-18-9-5-4-6-10-18/h7-8,12H,2-6,9-11,17H2,1H3