N-(2-dimethylaminoethyl)-4-methyl-3-nitro-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-methyl-3-nitro-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]benzamide Openeye Name: N-(2-dimethylaminoethyl)-4-methyl-3-nitro-N-[2-oxo-2-(thiazol-2-ylamino)ethyl]benzamide CAS Name: N-(2-dimethylaminoethyl)-4-methyl-3-nitro-N-[2-oxo-2-(2-thiazolylamino)ethyl]benzamide IUPAC Name: N-(2-dimethylaminoethyl)-4-methyl-3-nitro-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]benzamide Traditional Name: N-(2-dimethylaminoethyl)-N-[2-keto-2-(thiazol-2-ylamino)ethyl]-4-methyl-3-nitro-benzamide Formula: C17H21N5O4S MolecularWeight: 391.44474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N5O4S/c1-12-4-5-13(10-14(12)22(25)26)16(24)21(8-7-20(2)3)11-15(23)19-17-18-6-9-27-17/h4-6,9-10H,7-8,11H2,1-3H3,(H,18,19,23)