N-(2-dimethylaminoethyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide hydrochloride

Systemtic Name: N-(2-dimethylaminoethyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide hydrochloride Openeye Name: N-(2-dimethylaminoethyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide hydrochloride CAS Name: N-(2-dimethylaminoethyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-2-nitrobenzamide hydrochloride IUPAC Name: N-(2-dimethylaminoethyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-2-nitrobenzamide hydrochloride Traditional Name: N-(2-dimethylaminoethyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide hydrochloride Formula: C20H23ClN4O4S MolecularWeight: 450.93902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)OC)N=C(S2)N(CCN(C)C)C(=O)C3=CC=CC=C3[N+](=O)[O-].Cl

Isomeric SMILES

CC1=C2C(=C(C=C1)OC)N=C(S2)N(CCN(C)C)C(=O)C3=CC=CC=C3[N+](=O)[O-].Cl

InChI

InChI=1S/C20H22N4O4S.ClH/c1-13-9-10-16(28-4)17-18(13)29-20(21-17)23(12-11-22(2)3)19(25)14-7-5-6-8-15(14)24(26)27;/h5-10H,11-12H2,1-4H3;1H