5-chloranyl-N-[2-[(1-phenylethylamino)methyl]-3,4-dihydro-2H-chromen-7-yl]thiophene-2-sulfonamide

Systemtic Name: 5-chloranyl-N-[2-[(1-phenylethylamino)methyl]-3,4-dihydro-2H-chromen-7-yl]thiophene-2-sulfonamide Openeye Name: 5-chloro-N-[2-[(1-phenylethylamino)methyl]chroman-7-yl]thiophene-2-sulfonamide CAS Name: 5-chloro-N-[2-[(1-phenylethylamino)methyl]-3,4-dihydro-2H-1-benzopyran-7-yl]-2-thiophenesulfonamide IUPAC Name: 5-chloro-N-[2-[(1-phenylethylamino)methyl]-3,4-dihydro-2H-chromen-7-yl]thiophene-2-sulfonamide Traditional Name: 5-chloro-N-[2-[(1-phenylethylamino)methyl]chroman-7-yl]thiophene-2-sulfonamide Formula: C22H23ClN2O3S2 MolecularWeight: 463.01262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NCC2CCC3=C(O2)C=C(C=C3)NS(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

CC(C1=CC=CC=C1)NCC2CCC3=C(O2)C=C(C=C3)NS(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C22H23ClN2O3S2/c1-15(16-5-3-2-4-6-16)24-14-19-10-8-17-7-9-18(13-20(17)28-19)25-30(26,27)22-12-11-21(23)29-22/h2-7,9,11-13,15,19,24-25H,8,10,14H2,1H3