2-[(4-methoxy-2-nitro-phenyl)carbamothioylamino]-N-(2-methyl-6-propan-2-yl-phenyl)-2-phenyl-ethanamide

Systemtic Name: 2-[(4-methoxy-2-nitro-phenyl)carbamothioylamino]-N-(2-methyl-6-propan-2-yl-phenyl)-2-phenyl-ethanamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)-2-[(4-methoxy-2-nitro-phenyl)carbamothioylamino]-2-phenyl-acetamide CAS Name: 2-[[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]amino]-N-(2-methyl-6-propan-2-ylphenyl)-2-phenylacetamide IUPAC Name: 2-[(4-methoxy-2-nitrophenyl)carbamothioylamino]-N-(2-methyl-6-propan-2-ylphenyl)-2-phenylacetamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)-2-[(4-methoxy-2-nitro-phenyl)thiocarbamoylamino]-2-phenyl-acetamide Formula: C26H28N4O4S MolecularWeight: 492.58992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)C(C2=CC=CC=C2)NC(=S)NC3=C(C=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)C(C2=CC=CC=C2)NC(=S)NC3=C(C=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C26H28N4O4S/c1-16(2)20-12-8-9-17(3)23(20)28-25(31)24(18-10-6-5-7-11-18)29-26(35)27-21-14-13-19(34-4)15-22(21)30(32)33/h5-16,24H,1-4H3,(H,28,31)(H2,27,29,35)