4-[4-(azepan-1-ylsulfonyl)phenyl]-3-(2-morpholin-4-ylethyl)-N-phenyl-1,3-thiazol-2-imine

Systemtic Name: 4-[4-(azepan-1-ylsulfonyl)phenyl]-3-(2-morpholin-4-ylethyl)-N-phenyl-1,3-thiazol-2-imine Openeye Name: 4-[4-(azepan-1-ylsulfonyl)phenyl]-3-(2-morpholinoethyl)-N-phenyl-thiazol-2-imine CAS Name: 4-[4-(1-azepanylsulfonyl)phenyl]-3-[2-(4-morpholinyl)ethyl]-N-phenyl-2-thiazolimine IUPAC Name: 4-[4-(azepan-1-ylsulfonyl)phenyl]-3-(2-morpholin-4-ylethyl)-N-phenyl-1,3-thiazol-2-imine Traditional Name: [4-[4-(azepan-1-ylsulfonyl)phenyl]-3-(2-morpholinoethyl)-4-thiazolin-2-ylidene]-phenyl-amine Formula: C27H34N4O3S2 MolecularWeight: 526.71386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=NC4=CC=CC=C4)N3CCN5CCOCC5

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=NC4=CC=CC=C4)N3CCN5CCOCC5

InChI

InChI=1S/C27H34N4O3S2/c32-36(33,30-14-6-1-2-7-15-30)25-12-10-23(11-13-25)26-22-35-27(28-24-8-4-3-5-9-24)31(26)17-16-29-18-20-34-21-19-29/h3-5,8-13,22H,1-2,6-7,14-21H2