N-[1,3-bis(3-bromanyl-4-methoxy-phenyl)-5-methyl-cyclohexyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-[1,3-bis(3-bromanyl-4-methoxy-phenyl)-5-methyl-cyclohexyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-[1,3-bis(3-bromo-4-methoxy-phenyl)-5-methyl-cyclohexyl]-1,3,4-thiadiazol-2-amine CAS Name: N-[1,3-bis(3-bromo-4-methoxyphenyl)-5-methylcyclohexyl]-1,3,4-thiadiazol-2-amine IUPAC Name: N-[1,3-bis(3-bromo-4-methoxyphenyl)-5-methylcyclohexyl]-1,3,4-thiadiazol-2-amine Traditional Name: [1,3-bis(3-bromo-4-methoxy-phenyl)-5-methyl-cyclohexyl]-(1,3,4-thiadiazol-2-yl)amine Formula: C23H25Br2N3O2S MolecularWeight: 567.3365

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C2=CC(=C(C=C2)OC)Br)NC3=NN=CS3)C4=CC(=C(C=C4)OC)Br

Isomeric SMILES

CC1CC(CC(C1)(C2=CC(=C(C=C2)OC)Br)NC3=NN=CS3)C4=CC(=C(C=C4)OC)Br

InChI

InChI=1S/C23H25Br2N3O2S/c1-14-8-16(15-4-6-20(29-2)18(24)9-15)12-23(11-14,27-22-28-26-13-31-22)17-5-7-21(30-3)19(25)10-17/h4-7,9-10,13-14,16H,8,11-12H2,1-3H3,(H,27,28)