N'-[3-(butylaminomethyl)-4-methylsulfanyl-phenyl]thiophene-2-carboximidamide

Systemtic Name: N'-[3-(butylaminomethyl)-4-methylsulfanyl-phenyl]thiophene-2-carboximidamide Openeye Name: N'-[3-(butylaminomethyl)-4-methylsulfanyl-phenyl]thiophene-2-carboxamidine CAS Name: N'-[3-(butylaminomethyl)-4-(methylthio)phenyl]-2-thiophenecarboximidamide IUPAC Name: N'-[3-(butylaminomethyl)-4-methylsulfanylphenyl]thiophene-2-carboximidamide Traditional Name: N'-[3-(butylaminomethyl)-4-(methylthio)phenyl]thiophene-2-carboxamidine Formula: C17H23N3S2 MolecularWeight: 333.51462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=C(C=CC(=C1)N=C(C2=CC=CS2)N)SC

Isomeric SMILES

CCCCNCC1=C(C=CC(=C1)N=C(C2=CC=CS2)N)SC

InChI

InChI=1S/C17H23N3S2/c1-3-4-9-19-12-13-11-14(7-8-15(13)21-2)20-17(18)16-6-5-10-22-16/h5-8,10-11,19H,3-4,9,12H2,1-2H3,(H2,18,20)