4-chloranyl-N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]-2-methyl-butyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxopentan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxopentan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]-2-methyl-butyl]-3-nitro-benzamide Formula: C22H22ClN5O5S MolecularWeight: 503.95858

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)OC)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)OC)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H22ClN5O5S/c1-4-12(2)18(24-19(29)14-7-10-16(23)17(11-14)28(31)32)20(30)25-22-27-26-21(34-22)13-5-8-15(33-3)9-6-13/h5-12,18H,4H2,1-3H3,(H,24,29)(H,25,27,30)