2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-N-(2-piperidin-1-ylethyl)-1H-quinazoline-6-carboxamide

Systemtic Name: 2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-N-(2-piperidin-1-ylethyl)-1H-quinazoline-6-carboxamide Openeye Name: 4-oxo-2-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-N-[2-(1-piperidyl)ethyl]-1H-quinazoline-6-carboxamide CAS Name: 2-[[2-(4-methylphenyl)-2-oxoethyl]thio]-4-oxo-N-[2-(1-piperidinyl)ethyl]-1H-quinazoline-6-carboxamide IUPAC Name: 2-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-4-oxo-N-(2-piperidin-1-ylethyl)-1H-quinazoline-6-carboxamide Traditional Name: 4-keto-2-[[2-keto-2-(p-tolyl)ethyl]thio]-N-(2-piperidinoethyl)-1H-quinazoline-6-carboxamide Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC(=O)C3=C(N2)C=CC(=C3)C(=O)NCCN4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC(=O)C3=C(N2)C=CC(=C3)C(=O)NCCN4CCCCC4

InChI

InChI=1S/C25H28N4O3S/c1-17-5-7-18(8-6-17)22(30)16-33-25-27-21-10-9-19(15-20(21)24(32)28-25)23(31)26-11-14-29-12-3-2-4-13-29/h5-10,15H,2-4,11-14,16H2,1H3,(H,26,31)(H,27,28,32)