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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NN=C(S2)SCC(=O)CSC3=NN=C(S3)NCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NN=C(S2)SCC(=O)CSC3=NN=C(S3)NCC4=CC=CC=C4

InChI

InChI=1S/C21H20N6OS4/c28-17(13-29-20-26-24-18(31-20)22-11-15-7-3-1-4-8-15)14-30-21-27-25-19(32-21)23-12-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,22,24)(H,23,25)