N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitro-benzamide hydrochloride

Systemtic Name: N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitro-benzamide hydrochloride Openeye Name: N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitro-benzamide hydrochloride CAS Name: N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitrobenzamide hydrochloride IUPAC Name: N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitrobenzamide hydrochloride Traditional Name: N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitro-benzamide hydrochloride Formula: C19H21ClN4O3S MolecularWeight: 420.91304

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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=CC=C(C=C3)[N+](=O)[O-].Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H20N4O3S.ClH/c1-13-4-9-16-17(12-13)27-19(20-16)22(11-10-21(2)3)18(24)14-5-7-15(8-6-14)23(25)26;/h4-9,12H,10-11H2,1-3H3;1H