4-[3-(1-methyl-4-oxidanyl-piperidin-4-yl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide

Systemtic Name: 4-[3-(1-methyl-4-oxidanyl-piperidin-4-yl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide Openeye Name: 4-[3-(4-hydroxy-1-methyl-4-piperidyl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboxamidine CAS Name: 4-[3-(4-hydroxy-1-methyl-4-piperidinyl)phenyl]sulfonyl-5-(methylthio)-2-thiophenecarboximidamide IUPAC Name: 4-[3-(4-hydroxy-1-methylpiperidin-4-yl)phenyl]sulfonyl-5-methylsulfanylthiophene-2-carboximidamide Traditional Name: 4-[3-(4-hydroxy-1-methyl-4-piperidyl)phenyl]sulfonyl-5-(methylthio)thiophene-2-carboxamidine Formula: C18H23N3O3S3 MolecularWeight: 425.58852

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)(C2=CC(=CC=C2)S(=O)(=O)C3=C(SC(=C3)C(=N)N)SC)O

Isomeric SMILES

CN1CCC(CC1)(C2=CC(=CC=C2)S(=O)(=O)C3=C(SC(=C3)C(=N)N)SC)O

InChI

InChI=1S/C18H23N3O3S3/c1-21-8-6-18(22,7-9-21)12-4-3-5-13(10-12)27(23,24)15-11-14(16(19)20)26-17(15)25-2/h3-5,10-11,22H,6-9H2,1-2H3,(H3,19,20)