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

Systemtic Name: 4-[3-(azepan-1-ylsulfonyl)phenyl]-3-(3-methoxypropyl)-N-phenyl-1,3-thiazol-2-imine Openeye Name: 4-[3-(azepan-1-ylsulfonyl)phenyl]-3-(3-methoxypropyl)-N-phenyl-thiazol-2-imine CAS Name: 4-[3-(1-azepanylsulfonyl)phenyl]-3-(3-methoxypropyl)-N-phenyl-2-thiazolimine IUPAC Name: 4-[3-(azepan-1-ylsulfonyl)phenyl]-3-(3-methoxypropyl)-N-phenyl-1,3-thiazol-2-imine Traditional Name: [4-[3-(azepan-1-ylsulfonyl)phenyl]-3-(3-methoxypropyl)-4-thiazolin-2-ylidene]-phenyl-amine Formula: C25H31N3O3S2 MolecularWeight: 485.66194

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COCCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H31N3O3S2/c1-31-18-10-17-28-24(20-32-25(28)26-22-12-5-4-6-13-22)21-11-9-14-23(19-21)33(29,30)27-15-7-2-3-8-16-27/h4-6,9,11-14,19-20H,2-3,7-8,10,15-18H2,1H3