N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[(4-nitrophenyl)carbamoylamino]pentanamide

Systemtic Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[(4-nitrophenyl)carbamoylamino]pentanamide Openeye Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[(4-nitrophenyl)carbamoylamino]pentanamide CAS Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[[(4-nitroanilino)-oxomethyl]amino]pentanamide IUPAC Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[(4-nitrophenyl)carbamoylamino]pentanamide Traditional Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[(4-nitrophenyl)carbamoylamino]valeramide Formula: C22H24N6O5S MolecularWeight: 484.52816

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC(=CC=C2)OC)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC(=CC=C2)OC)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H24N6O5S/c1-4-13(2)18(24-21(30)23-15-8-10-16(11-9-15)28(31)32)19(29)25-22-27-26-20(34-22)14-6-5-7-17(12-14)33-3/h5-13,18H,4H2,1-3H3,(H2,23,24,30)(H,25,27,29)