N-[(2S)-1-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide

Systemtic Name: N-[(2S)-1-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide Openeye Name: N-[(1S)-1-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]-3-methylsulfanyl-propyl]-3-methyl-benzamide CAS Name: N-[(2S)-1-[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]amino]-4-(methylthio)-1-oxobutan-2-yl]-3-methylbenzamide IUPAC Name: N-[(2S)-1-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-4-methylsulfanyl-1-oxobutan-2-yl]-3-methylbenzamide Traditional Name: N-[(1S)-1-[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]carbamoyl]-3-(methylthio)propyl]-3-methyl-benzamide Formula: C17H22N4O2S3 MolecularWeight: 410.57718

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C(CCSC)NC(=O)C2=CC(=CC=C2)C

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)[C@H](CCSC)NC(=O)C2=CC(=CC=C2)C

InChI

InChI=1S/C17H22N4O2S3/c1-4-25-17-21-20-16(26-17)19-15(23)13(8-9-24-3)18-14(22)12-7-5-6-11(2)10-12/h5-7,10,13H,4,8-9H2,1-3H3,(H,18,22)(H,19,20,23)/t13-/m0/s1