1,3-bis[[5-[(2-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]propan-2-one

Systemtic Name: 1,3-bis[[5-[(2-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]propan-2-one Openeye Name: 1,3-bis[[5-(2-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-2-one CAS Name: 1,3-bis[[5-(2-methylanilino)-1,3,4-thiadiazol-2-yl]thio]-2-propanone IUPAC Name: 1,3-bis[[5-(2-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-2-one Traditional Name: 1,3-bis[[5-(o-toluidino)-1,3,4-thiadiazol-2-yl]thio]acetone Formula: C21H20N6OS4 MolecularWeight: 500.6831

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NN=C(S2)SCC(=O)CSC3=NN=C(S3)NC4=CC=CC=C4C

Isomeric SMILES

CC1=CC=CC=C1NC2=NN=C(S2)SCC(=O)CSC3=NN=C(S3)NC4=CC=CC=C4C

InChI

InChI=1S/C21H20N6OS4/c1-13-7-3-5-9-16(13)22-18-24-26-20(31-18)29-11-15(28)12-30-21-27-25-19(32-21)23-17-10-6-4-8-14(17)2/h3-10H,11-12H2,1-2H3,(H,22,24)(H,23,25)