5-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-N-(3-methoxyphenyl)-4H-1,3,4-thiadiazin-2-amine

Systemtic Name: 5-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-N-(3-methoxyphenyl)-4H-1,3,4-thiadiazin-2-amine Openeye Name: 5-[1-(2-furylmethyl)-2,5-dimethyl-pyrrol-3-yl]-N-(3-methoxyphenyl)-4H-1,3,4-thiadiazin-2-amine CAS Name: 5-[1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]-N-(3-methoxyphenyl)-4H-1,3,4-thiadiazin-2-amine IUPAC Name: 5-[1-(furan-2-ylmethyl)-2,5-dimethylpyrrol-3-yl]-N-(3-methoxyphenyl)-4H-1,3,4-thiadiazin-2-amine Traditional Name: [5-[1-(2-furfuryl)-2,5-dimethyl-pyrrol-3-yl]-4H-1,3,4-thiadiazin-2-yl]-(3-methoxyphenyl)amine Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CO2)C)C3=CSC(=NN3)NC4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CO2)C)C3=CSC(=NN3)NC4=CC(=CC=C4)OC

InChI

InChI=1S/C21H22N4O2S/c1-14-10-19(15(2)25(14)12-18-8-5-9-27-18)20-13-28-21(24-23-20)22-16-6-4-7-17(11-16)26-3/h4-11,13,23H,12H2,1-3H3,(H,22,24)