N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-methyl-4-nitro-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-methyl-4-nitro-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-methyl-4-nitro-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-methyl-4-nitrobenzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-methyl-4-nitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-methyl-4-nitro-benzamide Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C23H19N3O3S/c1-3-16-8-11-18(12-9-16)25(23-24-19-6-4-5-7-21(19)30-23)22(27)17-10-13-20(26(28)29)15(2)14-17/h4-14H,3H2,1-2H3