4-[3-(2-nitrophenyl)prop-2-enylideneamino]-3-(3-propan-2-yloxyphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[3-(2-nitrophenyl)prop-2-enylideneamino]-3-(3-propan-2-yloxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(3-isopropoxyphenyl)-4-[3-(2-nitrophenyl)prop-2-enylideneamino]-1H-1,2,4-triazole-5-thione CAS Name: 4-[3-(2-nitrophenyl)prop-2-enylideneamino]-3-(3-propan-2-yloxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[3-(2-nitrophenyl)prop-2-enylideneamino]-3-(3-propan-2-yloxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(3-isopropoxyphenyl)-4-[3-(2-nitrophenyl)prop-2-enylideneamino]-1H-1,2,4-triazole-5-thione Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C2=NNC(=S)N2N=CC=CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C2=NNC(=S)N2N=CC=CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O3S/c1-14(2)28-17-10-5-8-16(13-17)19-22-23-20(29)24(19)21-12-6-9-15-7-3-4-11-18(15)25(26)27/h3-14H,1-2H3,(H,23,29)