S-(propylamino) 4-[(4-oxidanyl-5-phenoxy-pentyl)amino]piperidine-1-carbothioate

Systemtic Name: S-(propylamino) 4-[(4-oxidanyl-5-phenoxy-pentyl)amino]piperidine-1-carbothioate Openeye Name: S-(propylamino) 4-[(4-hydroxy-5-phenoxy-pentyl)amino]piperidine-1-carbothioate CAS Name: 4-[(4-hydroxy-5-phenoxypentyl)amino]-1-piperidinecarbothioic acid S-(propylamino) ester IUPAC Name: S-(propylamino) 4-[(4-hydroxy-5-phenoxypentyl)amino]piperidine-1-carbothioate Traditional Name: 4-[(4-hydroxy-5-phenoxy-pentyl)amino]piperidine-1-carbothioic acid S-(propylamino) ester Formula: C20H33N3O3S MolecularWeight: 395.55932

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Descriptors Computed from Structure

Canonical SMILES:

CCCNSC(=O)N1CCC(CC1)NCCCC(COC2=CC=CC=C2)O

Isomeric SMILES

CCCNSC(=O)N1CCC(CC1)NCCCC(COC2=CC=CC=C2)O

InChI

InChI=1S/C20H33N3O3S/c1-2-12-22-27-20(25)23-14-10-17(11-15-23)21-13-6-7-18(24)16-26-19-8-4-3-5-9-19/h3-5,8-9,17-18,21-22,24H,2,6-7,10-16H2,1H3