[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]phenyl] ethanoate

Systemtic Name: [2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]phenyl] ethanoate Openeye Name: [2-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamoyl]phenyl] acetate CAS Name: acetic acid [2-[[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-oxomethyl]phenyl] ester IUPAC Name: [2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]phenyl] acetate Traditional Name: acetic acid [2-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamoyl]phenyl] ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)NC2=C(C3=C(S2)CCCC3)C#N

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)NC2=C(C3=C(S2)CCCC3)C#N

InChI

InChI=1S/C18H16N2O3S/c1-11(21)23-15-8-4-2-7-13(15)17(22)20-18-14(10-19)12-6-3-5-9-16(12)24-18/h2,4,7-8H,3,5-6,9H2,1H3,(H,20,22)