ethyl 4-[[4-[(3-methyl-2-methylsulfanyl-4-oxidanylidene-quinazolin-7-yl)carbonylamino]piperidin-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[4-[(3-methyl-2-methylsulfanyl-4-oxidanylidene-quinazolin-7-yl)carbonylamino]piperidin-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[4-[(3-methyl-2-methylsulfanyl-4-oxo-quinazoline-7-carbonyl)amino]piperidine-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[4-[[[3-methyl-2-(methylthio)-4-oxo-7-quinazolinyl]-oxomethyl]amino]-4-piperidinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-[(3-methyl-2-methylsulfanyl-4-oxoquinazoline-7-carbonyl)amino]piperidine-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[4-[[4-keto-3-methyl-2-(methylthio)quinazoline-7-carbonyl]amino]isonipecotoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C25H34N6O5S MolecularWeight: 530.63966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2(CCNCC2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=N4)SC)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2(CCNCC2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=N4)SC)C

InChI

InChI=1S/C25H34N6O5S/c1-4-36-24(35)31-13-7-17(8-14-31)27-22(34)25(9-11-26-12-10-25)29-20(32)16-5-6-18-19(15-16)28-23(37-3)30(2)21(18)33/h5-6,15,17,26H,4,7-14H2,1-3H3,(H,27,34)(H,29,32)