2-azanyl-N-[3-(3,4-dimethylphenyl)sulfanylphenyl]butanamide

Systemtic Name: 2-azanyl-N-[3-(3,4-dimethylphenyl)sulfanylphenyl]butanamide Openeye Name: 2-amino-N-[3-(3,4-dimethylphenyl)sulfanylphenyl]butanamide CAS Name: 2-amino-N-[3-[(3,4-dimethylphenyl)thio]phenyl]butanamide IUPAC Name: 2-amino-N-[3-(3,4-dimethylphenyl)sulfanylphenyl]butanamide Traditional Name: 2-amino-N-[3-[(3,4-dimethylphenyl)thio]phenyl]butyramide Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=CC=C1)SC2=CC(=C(C=C2)C)C)N

Isomeric SMILES

CCC(C(=O)NC1=CC(=CC=C1)SC2=CC(=C(C=C2)C)C)N

InChI

InChI=1S/C18H22N2OS/c1-4-17(19)18(21)20-14-6-5-7-15(11-14)22-16-9-8-12(2)13(3)10-16/h5-11,17H,4,19H2,1-3H3,(H,20,21)