N-(3-methoxypropyl)-4-methyl-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-(3-methoxypropyl)-4-methyl-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-(3-methoxypropyl)-4-methyl-N-[2-[(4-methylthiazol-2-yl)amino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-(3-methoxypropyl)-4-methyl-N-[2-[(4-methyl-2-thiazolyl)amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-(3-methoxypropyl)-4-methyl-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-keto-2-[(4-methylthiazol-2-yl)amino]ethyl]-N-(3-methoxypropyl)-4-methyl-3-nitro-benzamide Formula: C18H22N4O5S MolecularWeight: 406.45608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CCCOC)CC(=O)NC2=NC(=CS2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CCCOC)CC(=O)NC2=NC(=CS2)C)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O5S/c1-12-5-6-14(9-15(12)22(25)26)17(24)21(7-4-8-27-3)10-16(23)20-18-19-13(2)11-28-18/h5-6,9,11H,4,7-8,10H2,1-3H3,(H,19,20,23)