2-azanyl-N-phenethyl-4-sulfanyl-butanamide

Systemtic Name: 2-azanyl-N-phenethyl-4-sulfanyl-butanamide Openeye Name: 2-amino-N-phenethyl-4-sulfanyl-butanamide CAS Name: 2-amino-4-mercapto-N-phenethylbutanamide IUPAC Name: 2-amino-N-phenethyl-4-sulfanylbutanamide Traditional Name: 2-amino-4-mercapto-N-phenethyl-butyramide Formula: C12H18N2OS MolecularWeight: 238.34912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C(CCS)N

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C(CCS)N

InChI

InChI=1S/C12H18N2OS/c13-11(7-9-16)12(15)14-8-6-10-4-2-1-3-5-10/h1-5,11,16H,6-9,13H2,(H,14,15)