1-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-6H-1,3,4-thiadiazin-5-yl]phenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-6H-1,3,4-thiadiazin-5-yl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-6H-1,3,4-thiadiazin-5-yl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-6H-1,3,4-thiadiazin-5-yl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-6H-1,3,4-thiadiazin-5-yl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[2-(piperonylamino)-6H-1,3,4-thiadiazin-5-yl]phenyl]-2-pyrrolidone Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)C3=NN=C(SC3)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)C3=NN=C(SC3)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H20N4O3S/c26-20-2-1-9-25(20)16-6-4-15(5-7-16)17-12-29-21(24-23-17)22-11-14-3-8-18-19(10-14)28-13-27-18/h3-8,10H,1-2,9,11-13H2,(H,22,24)