3,3-dimethyl-4-[(2S)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoyl]-1H-quinoxalin-2-one

Systemtic Name: 3,3-dimethyl-4-[(2S)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoyl]-1H-quinoxalin-2-one Openeye Name: 4-[(2S)-2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[(2S)-2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-1-oxopropyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[(2S)-2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[(2S)-2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C21H21N5O2S2 MolecularWeight: 439.55374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SC3=NN=C(S3)NC4=CC=CC=C4

Isomeric SMILES

C[C@@H](C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SC3=NN=C(S3)NC4=CC=CC=C4

InChI

InChI=1S/C21H21N5O2S2/c1-13(29-20-25-24-19(30-20)22-14-9-5-4-6-10-14)17(27)26-16-12-8-7-11-15(16)23-18(28)21(26,2)3/h4-13H,1-3H3,(H,22,24)(H,23,28)/t13-/m0/s1