2-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)carbamoyl]-6-nitro-benzoate

Systemtic Name: 2-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)carbamoyl]-6-nitro-benzoate Openeye Name: 2-[(5-methyl-4-phenyl-thiazol-2-yl)carbamoyl]-6-nitro-benzoate CAS Name: 2-[[(5-methyl-4-phenyl-2-thiazolyl)amino]-oxomethyl]-6-nitrobenzoate IUPAC Name: 2-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)carbamoyl]-6-nitrobenzoate Traditional Name: 2-[(5-methyl-4-phenyl-thiazol-2-yl)carbamoyl]-6-nitro-benzoate Formula: C18H12N3O5S- MolecularWeight: 382.36998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H13N3O5S/c1-10-15(11-6-3-2-4-7-11)19-18(27-10)20-16(22)12-8-5-9-13(21(25)26)14(12)17(23)24/h2-9H,1H3,(H,23,24)(H,19,20,22)/p-1