N-(1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-5-nitro-thiophene-2-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-5-nitro-thiophene-2-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-5-nitro-thiophene-2-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-5-nitro-2-thiophenecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-5-nitrothiophene-2-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-5-nitro-thiophene-2-carboxamide Formula: C17H18N4O3S2 MolecularWeight: 390.47982

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O3S2/c1-19(2)10-5-11-20(16(22)14-8-9-15(25-14)21(23)24)17-18-12-6-3-4-7-13(12)26-17/h3-4,6-9H,5,10-11H2,1-2H3