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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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