5-(1,3-benzodioxol-5-yl)-7-hexyl-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-7-hexyl-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one Openeye Name: 5-(1,3-benzodioxol-5-yl)-7-hexyl-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one CAS Name: 5-(1,3-benzodioxol-5-yl)-7-hexyl-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one IUPAC Name: 5-(1,3-benzodioxol-5-yl)-7-hexyl-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one Traditional Name: 5-(1,3-benzodioxol-5-yl)-7-hexyl-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one Formula: C20H22N2O3S MolecularWeight: 370.46528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(NCC(=O)N=C2S1)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCCCC1=CC2=C(NCC(=O)N=C2S1)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N2O3S/c1-2-3-4-5-6-14-10-15-19(21-11-18(23)22-20(15)26-14)13-7-8-16-17(9-13)25-12-24-16/h7-10,21H,2-6,11-12H2,1H3