3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[3-[(3,4-dimethylphenyl)sulfonylamino]phenyl]propanamide

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[3-[(3,4-dimethylphenyl)sulfonylamino]phenyl]propanamide Openeye Name: 3-(2-amino-2-oxo-ethyl)sulfanyl-N-[3-[(3,4-dimethylphenyl)sulfonylamino]phenyl]propanamide CAS Name: 3-[(2-amino-2-oxoethyl)thio]-N-[3-[(3,4-dimethylphenyl)sulfonylamino]phenyl]propanamide IUPAC Name: 3-(2-amino-2-oxoethyl)sulfanyl-N-[3-[(3,4-dimethylphenyl)sulfonylamino]phenyl]propanamide Traditional Name: 3-[(2-amino-2-keto-ethyl)thio]-N-[3-[(3,4-dimethylphenyl)sulfonylamino]phenyl]propionamide Formula: C19H23N3O4S2 MolecularWeight: 421.53362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)NC(=O)CCSCC(=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)NC(=O)CCSCC(=O)N)C

InChI

InChI=1S/C19H23N3O4S2/c1-13-6-7-17(10-14(13)2)28(25,26)22-16-5-3-4-15(11-16)21-19(24)8-9-27-12-18(20)23/h3-7,10-11,22H,8-9,12H2,1-2H3,(H2,20,23)(H,21,24)