N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-5-nitro-1-benzothiophene-2-carboxamide hydrochloride

Systemtic Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-5-nitro-1-benzothiophene-2-carboxamide hydrochloride Openeye Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-5-nitro-benzothiophene-2-carboxamide hydrochloride CAS Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-5-nitro-1-benzothiophene-2-carboxamide hydrochloride IUPAC Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-5-nitro-1-benzothiophene-2-carboxamide hydrochloride Traditional Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-5-nitro-benzothiophene-2-carboxamide hydrochloride Formula: C22H23ClN4O3S2 MolecularWeight: 491.02602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(S2)N(CCN(C)C)C(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])C.Cl

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(S2)N(CCN(C)C)C(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])C.Cl

InChI

InChI=1S/C22H22N4O3S2.ClH/c1-13-9-14(2)20-17(10-13)23-22(31-20)25(8-7-24(3)4)21(27)19-12-15-11-16(26(28)29)5-6-18(15)30-19;/h5-6,9-12H,7-8H2,1-4H3;1H