3-azanyl-N-butyl-4-ethylsulfanyl-benzamide

Systemtic Name: 3-azanyl-N-butyl-4-ethylsulfanyl-benzamide Openeye Name: 3-amino-N-butyl-4-ethylsulfanyl-benzamide CAS Name: 3-amino-N-butyl-4-(ethylthio)benzamide IUPAC Name: 3-amino-N-butyl-4-ethylsulfanylbenzamide Traditional Name: 3-amino-N-butyl-4-(ethylthio)benzamide Formula: C13H20N2OS MolecularWeight: 252.3757

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=C(C=C1)SCC)N

Isomeric SMILES

CCCCNC(=O)C1=CC(=C(C=C1)SCC)N

InChI

InChI=1S/C13H20N2OS/c1-3-5-8-15-13(16)10-6-7-12(17-4-2)11(14)9-10/h6-7,9H,3-5,8,14H2,1-2H3,(H,15,16)