2-[(5-methoxy-3,4-dihydro-2H-chromen-3-yl)-propyl-amino]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[(5-methoxy-3,4-dihydro-2H-chromen-3-yl)-propyl-amino]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[(5-methoxychroman-3-yl)-propyl-amino]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[(5-methoxy-3,4-dihydro-2H-1-benzopyran-3-yl)-propylamino]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[(5-methoxy-3,4-dihydro-2H-chromen-3-yl)-propylamino]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-[(5-methoxychroman-3-yl)-propyl-amino]-1,2-benzothiazol-3-one Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CC2=C(C=CC=C2OC)OC1)N3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

CCCN(C1CC2=C(C=CC=C2OC)OC1)N3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C20H22N2O5S/c1-3-11-21(14-12-16-17(26-2)8-6-9-18(16)27-13-14)22-20(23)15-7-4-5-10-19(15)28(22,24)25/h4-10,14H,3,11-13H2,1-2H3