4-(1,3-benzothiazol-2-ylsulfanyl)-1-[2-(2-methylphenyl)imino-1,3-thiazolidin-3-yl]butan-1-one

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-1-[2-(2-methylphenyl)imino-1,3-thiazolidin-3-yl]butan-1-one Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-1-[2-(o-tolylimino)thiazolidin-3-yl]butan-1-one CAS Name: 4-(1,3-benzothiazol-2-ylthio)-1-[2-(2-methylphenyl)imino-3-thiazolidinyl]-1-butanone IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-1-[2-(2-methylphenyl)imino-1,3-thiazolidin-3-yl]butan-1-one Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-1-[2-(o-tolylimino)thiazolidin-3-yl]butan-1-one Formula: C21H21N3OS3 MolecularWeight: 427.60594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N=C2N(CCS2)C(=O)CCCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=CC=C1N=C2N(CCS2)C(=O)CCCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H21N3OS3/c1-15-7-2-3-8-16(15)22-20-24(12-14-26-20)19(25)11-6-13-27-21-23-17-9-4-5-10-18(17)28-21/h2-5,7-10H,6,11-14H2,1H3