N-[6-cyano-8-(pyridin-4-ylmethylamino)-3,4-dihydro-2H-chromen-3-yl]-N-(thiophen-3-ylmethyl)methanesulfonamide

Systemtic Name: N-[6-cyano-8-(pyridin-4-ylmethylamino)-3,4-dihydro-2H-chromen-3-yl]-N-(thiophen-3-ylmethyl)methanesulfonamide Openeye Name: N-[6-cyano-8-(4-pyridylmethylamino)chroman-3-yl]-N-(3-thienylmethyl)methanesulfonamide CAS Name: N-[6-cyano-8-(pyridin-4-ylmethylamino)-3,4-dihydro-2H-1-benzopyran-3-yl]-N-(3-thiophenylmethyl)methanesulfonamide IUPAC Name: N-[6-cyano-8-(pyridin-4-ylmethylamino)-3,4-dihydro-2H-chromen-3-yl]-N-(thiophen-3-ylmethyl)methanesulfonamide Traditional Name: N-[6-cyano-8-(4-pyridylmethylamino)chroman-3-yl]-N-(3-thenyl)methanesulfonamide Formula: C22H22N4O3S2 MolecularWeight: 454.56508

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CSC=C1)C2CC3=C(C(=CC(=C3)C#N)NCC4=CC=NC=C4)OC2

Isomeric SMILES

CS(=O)(=O)N(CC1=CSC=C1)C2CC3=C(C(=CC(=C3)C#N)NCC4=CC=NC=C4)OC2

InChI

InChI=1S/C22H22N4O3S2/c1-31(27,28)26(13-17-4-7-30-15-17)20-10-19-8-18(11-23)9-21(22(19)29-14-20)25-12-16-2-5-24-6-3-16/h2-9,15,20,25H,10,12-14H2,1H3