N-(1,3-benzothiazol-2-yl)-2-chloranyl-N-(2-diethylaminoethyl)-5-nitro-benzamide hydrochloride

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-chloranyl-N-(2-diethylaminoethyl)-5-nitro-benzamide hydrochloride Openeye Name: N-(1,3-benzothiazol-2-yl)-2-chloro-N-(2-diethylaminoethyl)-5-nitro-benzamide hydrochloride CAS Name: N-(1,3-benzothiazol-2-yl)-2-chloro-N-(2-diethylaminoethyl)-5-nitrobenzamide hydrochloride IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-chloro-N-(2-diethylaminoethyl)-5-nitrobenzamide hydrochloride Traditional Name: N-(1,3-benzothiazol-2-yl)-2-chloro-N-(2-diethylaminoethyl)-5-nitro-benzamide hydrochloride Formula: C20H22Cl2N4O3S MolecularWeight: 469.38468

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl.Cl

Isomeric SMILES

CCN(CC)CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl.Cl

InChI

InChI=1S/C20H21ClN4O3S.ClH/c1-3-23(4-2)11-12-24(20-22-17-7-5-6-8-18(17)29-20)19(26)15-13-14(25(27)28)9-10-16(15)21;/h5-10,13H,3-4,11-12H2,1-2H3;1H