5-chloranyl-N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide hydrochloride

Systemtic Name: 5-chloranyl-N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide hydrochloride Openeye Name: 5-chloro-N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide hydrochloride CAS Name: 5-chloro-N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-2-nitrobenzamide hydrochloride IUPAC Name: 5-chloro-N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-2-nitrobenzamide hydrochloride Traditional Name: 5-chloro-N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide hydrochloride Formula: C19H20Cl2N4O3S MolecularWeight: 455.3581

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N(CCN(C)C)C(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-].Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N(CCN(C)C)C(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-].Cl

InChI

InChI=1S/C19H19ClN4O3S.ClH/c1-12-4-6-15-17(10-12)28-19(21-15)23(9-8-22(2)3)18(25)14-11-13(20)5-7-16(14)24(26)27;/h4-7,10-11H,8-9H2,1-3H3;1H