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

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-3-nitro-benzamide hydrochloride Openeye Name: N-[4-(3,4-dimethoxyphenyl)-5-methyl-thiazol-2-yl]-3-nitro-benzamide hydrochloride CAS Name: N-[4-(3,4-dimethoxyphenyl)-5-methyl-2-thiazolyl]-3-nitrobenzamide hydrochloride IUPAC Name: N-[4-(3,4-dimethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-3-nitrobenzamide hydrochloride Traditional Name: N-[4-(3,4-dimethoxyphenyl)-5-methyl-thiazol-2-yl]-3-nitro-benzamide hydrochloride Formula: C19H18ClN3O5S MolecularWeight: 435.88132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=C(C=C3)OC)OC.Cl

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=C(C=C3)OC)OC.Cl

InChI

InChI=1S/C19H17N3O5S.ClH/c1-11-17(12-7-8-15(26-2)16(10-12)27-3)20-19(28-11)21-18(23)13-5-4-6-14(9-13)22(24)25;/h4-10H,1-3H3,(H,20,21,23);1H