2-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-3-methyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: 2-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-3-methyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: 2-[(4-chloro-3-nitro-phenyl)sulfonylamino]-3-methyl-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]butanamide CAS Name: 2-[(4-chloro-3-nitrophenyl)sulfonylamino]-3-methyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 2-[(4-chloro-3-nitrophenyl)sulfonylamino]-3-methyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: 2-[(4-chloro-3-nitro-phenyl)sulfonylamino]-3-methyl-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]butyramide Formula: C20H20ClN5O5S2 MolecularWeight: 509.9863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C(C(C)C)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C(C(C)C)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H20ClN5O5S2/c1-11(2)17(25-33(30,31)14-7-8-15(21)16(10-14)26(28)29)18(27)22-20-24-23-19(32-20)13-6-4-5-12(3)9-13/h4-11,17,25H,1-3H3,(H,22,24,27)