7-[(5-aminocarbonyl-2-piperidin-1-yl-phenyl)carbamoyl]-3-ethyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 7-[(5-aminocarbonyl-2-piperidin-1-yl-phenyl)carbamoyl]-3-ethyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 7-[[5-carbamoyl-2-(1-piperidyl)phenyl]carbamoyl]-3-ethyl-2-thioxo-quinazolin-4-olate CAS Name: 7-[[5-carbamoyl-2-(1-piperidinyl)anilino]-oxomethyl]-3-ethyl-2-sulfanylidene-4-quinazolinolate IUPAC Name: 7-[(5-carbamoyl-2-piperidin-1-ylphenyl)carbamoyl]-3-ethyl-2-sulfanylidenequinazolin-4-olate Traditional Name: 7-[(5-carbamoyl-2-piperidino-phenyl)carbamoyl]-3-ethyl-2-thioxo-quinazolin-4-olate Formula: C23H24N5O3S- MolecularWeight: 450.53336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C=CC(=CC2=NC1=S)C(=O)NC3=C(C=CC(=C3)C(=O)N)N4CCCCC4)[O-]

Isomeric SMILES

CCN1C(=C2C=CC(=CC2=NC1=S)C(=O)NC3=C(C=CC(=C3)C(=O)N)N4CCCCC4)[O-]

InChI

InChI=1S/C23H25N5O3S/c1-2-28-22(31)16-8-6-15(13-17(16)26-23(28)32)21(30)25-18-12-14(20(24)29)7-9-19(18)27-10-4-3-5-11-27/h6-9,12-13,31H,2-5,10-11H2,1H3,(H2,24,29)(H,25,30)/p-1