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

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[5-(4-nitrophenyl)sulfonylthiazol-2-yl]butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-(5-nosylthiazol-2-yl)butyramide Formula: C20H16N4O5S3 MolecularWeight: 488.55984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)NC3=NC=C(S3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)NC3=NC=C(S3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H16N4O5S3/c25-17(6-3-7-18-22-15-4-1-2-5-16(15)30-18)23-20-21-12-19(31-20)32(28,29)14-10-8-13(9-11-14)24(26)27/h1-2,4-5,8-12H,3,6-7H2,(H,21,23,25)