5-(1,3-benzothiazol-2-yl)-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-[4-(4-nitrophenyl)thiazol-2-yl]thiophene-2-carboxamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-[4-(4-nitrophenyl)-2-thiazolyl]-2-thiophenecarboxamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-[4-(4-nitrophenyl)thiazol-2-yl]thiophene-2-carboxamide Formula: C21H12N4O3S3 MolecularWeight: 464.53998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(S3)C(=O)NC4=NC(=CS4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(S3)C(=O)NC4=NC(=CS4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C21H12N4O3S3/c26-19(17-9-10-18(30-17)20-22-14-3-1-2-4-16(14)31-20)24-21-23-15(11-29-21)12-5-7-13(8-6-12)25(27)28/h1-11H,(H,23,24,26)