(4-oxidanylidene-4-thiophen-2-yl-butyl) 4-[(propan-2-ylcarbamoylamino)methyl]benzoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 4-[(isopropylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzoic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(isopropylcarbamoylamino)methyl]benzoic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OCCCC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OCCCC(=O)C2=CC=CS2

InChI

InChI=1S/C20H24N2O4S/c1-14(2)22-20(25)21-13-15-7-9-16(10-8-15)19(24)26-11-3-5-17(23)18-6-4-12-27-18/h4,6-10,12,14H,3,5,11,13H2,1-2H3,(H2,21,22,25)