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

Systemtic Name: 5-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-N-(2-nitrophenyl)-6H-1,3,4-thiadiazin-2-amine Openeye Name: 5-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-N-(2-nitrophenyl)-6H-1,3,4-thiadiazin-2-amine CAS Name: 5-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-N-(2-nitrophenyl)-6H-1,3,4-thiadiazin-2-amine IUPAC Name: 5-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-N-(2-nitrophenyl)-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]-(2-nitrophenyl)amine Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C2=NN=C(SC2)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C2=NN=C(SC2)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O2S/c1-4-9-22-12(2)10-14(13(22)3)16-11-26-18(21-20-16)19-15-7-5-6-8-17(15)23(24)25/h4-8,10H,1,9,11H2,2-3H3,(H,19,21)