N-(1,3-benzodioxol-5-ylmethyl)-5-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-6H-1,3,4-thiadiazin-2-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-6H-1,3,4-thiadiazin-2-amine Openeye Name: 5-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-N-(1,3-benzodioxol-5-ylmethyl)-6H-1,3,4-thiadiazin-2-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-6H-1,3,4-thiadiazin-2-amine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-6H-1,3,4-thiadiazin-2-amine Traditional Name: [5-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-6H-1,3,4-thiadiazin-2-yl]-piperonyl-amine Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C2=NN=C(SC2)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C2=NN=C(SC2)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N4O2S/c1-4-7-24-13(2)8-16(14(24)3)17-11-27-20(23-22-17)21-10-15-5-6-18-19(9-15)26-12-25-18/h4-6,8-9H,1,7,10-12H2,2-3H3,(H,21,23)