3-methyl-N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]-4-nitro-benzamide

Systemtic Name: 3-methyl-N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]-4-nitro-benzamide Openeye Name: 3-methyl-N-[2-[5-(2-methylthiazol-4-yl)-2-thienyl]ethyl]-4-nitro-benzamide CAS Name: 3-methyl-N-[2-[5-(2-methyl-4-thiazolyl)-2-thiophenyl]ethyl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]-4-nitrobenzamide Traditional Name: 3-methyl-N-[2-[5-(2-methylthiazol-4-yl)-2-thienyl]ethyl]-4-nitro-benzamide Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCCC2=CC=C(S2)C3=CSC(=N3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCCC2=CC=C(S2)C3=CSC(=N3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3S2/c1-11-9-13(3-5-16(11)21(23)24)18(22)19-8-7-14-4-6-17(26-14)15-10-25-12(2)20-15/h3-6,9-10H,7-8H2,1-2H3,(H,19,22)