[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl] 4-butylbenzoate

Systemtic Name: [2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl] 4-butylbenzoate Openeye Name: [2-[(3-carbamoyl-2-thienyl)amino]-2-oxo-ethyl] 4-butylbenzoate CAS Name: 4-butylbenzoic acid [2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl] 4-butylbenzoate Traditional Name: 4-butylbenzoic acid [2-[(3-carbamoyl-2-thienyl)amino]-2-keto-ethyl] ester Formula: C18H20N2O4S MolecularWeight: 360.4274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)OCC(=O)NC2=C(C=CS2)C(=O)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)OCC(=O)NC2=C(C=CS2)C(=O)N

InChI

InChI=1S/C18H20N2O4S/c1-2-3-4-12-5-7-13(8-6-12)18(23)24-11-15(21)20-17-14(16(19)22)9-10-25-17/h5-10H,2-4,11H2,1H3,(H2,19,22)(H,20,21)