3-[2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoyl-(phenylmethyl)amino]propanamide

Systemtic Name: 3-[2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoyl-(phenylmethyl)amino]propanamide Openeye Name: 3-[[2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]-benzyl-amino]propanamide CAS Name: 3-[[2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-1-oxoethyl]-(phenylmethyl)amino]propanamide IUPAC Name: 3-[[2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]-benzylamino]propanamide Traditional Name: 3-[[2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]acetyl]-benzyl-amino]propionamide Formula: C20H21N5O2S2 MolecularWeight: 427.54304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC(=O)N)C(=O)CSC2=NN=C(S2)NC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC(=O)N)C(=O)CSC2=NN=C(S2)NC3=CC=CC=C3

InChI

InChI=1S/C20H21N5O2S2/c21-17(26)11-12-25(13-15-7-3-1-4-8-15)18(27)14-28-20-24-23-19(29-20)22-16-9-5-2-6-10-16/h1-10H,11-14H2,(H2,21,26)(H,22,23)