4-(1-benzofuran-2-yl)-3-(3-imidazol-1-ylpropyl)-N-(4-morpholin-4-ylsulfonylphenyl)-1,3-thiazol-2-imine

Systemtic Name: 4-(1-benzofuran-2-yl)-3-(3-imidazol-1-ylpropyl)-N-(4-morpholin-4-ylsulfonylphenyl)-1,3-thiazol-2-imine Openeye Name: 4-(benzofuran-2-yl)-3-(3-imidazol-1-ylpropyl)-N-(4-morpholinosulfonylphenyl)thiazol-2-imine CAS Name: 4-(2-benzofuranyl)-3-[3-(1-imidazolyl)propyl]-N-[4-(4-morpholinylsulfonyl)phenyl]-2-thiazolimine IUPAC Name: 4-(1-benzofuran-2-yl)-3-(3-imidazol-1-ylpropyl)-N-(4-morpholin-4-ylsulfonylphenyl)-1,3-thiazol-2-imine Traditional Name: [4-(benzofuran-2-yl)-3-(3-imidazol-1-ylpropyl)-4-thiazolin-2-ylidene]-(4-morpholinosulfonylphenyl)amine Formula: C27H27N5O4S2 MolecularWeight: 549.66438

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)N=C3N(C(=CS3)C4=CC5=CC=CC=C5O4)CCCN6C=CN=C6

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)N=C3N(C(=CS3)C4=CC5=CC=CC=C5O4)CCCN6C=CN=C6

InChI

InChI=1S/C27H27N5O4S2/c33-38(34,31-14-16-35-17-15-31)23-8-6-22(7-9-23)29-27-32(12-3-11-30-13-10-28-20-30)24(19-37-27)26-18-21-4-1-2-5-25(21)36-26/h1-2,4-10,13,18-20H,3,11-12,14-17H2