4-[[4-methyl-5-[(4-nitrophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one

Systemtic Name: 4-[[4-methyl-5-[(4-nitrophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one Openeye Name: 4-[[4-methyl-5-[(4-nitrophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one CAS Name: 4-[[[4-methyl-5-[(4-nitrophenoxy)methyl]-1,2,4-triazol-3-yl]thio]methyl]-1H-quinolin-2-one IUPAC Name: 4-[[4-methyl-5-[(4-nitrophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one Traditional Name: 4-[[[4-methyl-5-[(4-nitrophenoxy)methyl]-1,2,4-triazol-3-yl]thio]methyl]carbostyril Formula: C20H17N5O4S MolecularWeight: 423.44508

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC(=O)NC3=CC=CC=C32)COC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN1C(=NN=C1SCC2=CC(=O)NC3=CC=CC=C32)COC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H17N5O4S/c1-24-18(11-29-15-8-6-14(7-9-15)25(27)28)22-23-20(24)30-12-13-10-19(26)21-17-5-3-2-4-16(13)17/h2-10H,11-12H2,1H3,(H,21,26)