3-(1,3-benzodioxol-5-ylmethyl)-4-(4-bromophenyl)-N-(4-morpholin-4-ylsulfonylphenyl)-1,3-thiazol-2-imine

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-(4-bromophenyl)-N-(4-morpholin-4-ylsulfonylphenyl)-1,3-thiazol-2-imine Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-(4-bromophenyl)-N-(4-morpholinosulfonylphenyl)thiazol-2-imine CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-(4-bromophenyl)-N-[4-(4-morpholinylsulfonyl)phenyl]-2-thiazolimine IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-(4-bromophenyl)-N-(4-morpholin-4-ylsulfonylphenyl)-1,3-thiazol-2-imine Traditional Name: [4-(4-bromophenyl)-3-piperonyl-4-thiazolin-2-ylidene]-(4-morpholinosulfonylphenyl)amine Formula: C27H24BrN3O5S2 MolecularWeight: 614.53056

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)N=C3N(C(=CS3)C4=CC=C(C=C4)Br)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)N=C3N(C(=CS3)C4=CC=C(C=C4)Br)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C27H24BrN3O5S2/c28-21-4-2-20(3-5-21)24-17-37-27(31(24)16-19-1-10-25-26(15-19)36-18-35-25)29-22-6-8-23(9-7-22)38(32,33)30-11-13-34-14-12-30/h1-10,15,17H,11-14,16,18H2