N-[4-[[4-azanyl-5-(5-methyl-1H-pyrazol-3-yl)-7-oxidanylidene-1H-quinazolin-2-yl]sulfanyl]phenyl]ethanamide

Systemtic Name: N-[4-[[4-azanyl-5-(5-methyl-1H-pyrazol-3-yl)-7-oxidanylidene-1H-quinazolin-2-yl]sulfanyl]phenyl]ethanamide Openeye Name: N-[4-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-7-oxo-1H-quinazolin-2-yl]sulfanyl]phenyl]acetamide CAS Name: N-[4-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-7-oxo-1H-quinazolin-2-yl]thio]phenyl]acetamide IUPAC Name: N-[4-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-7-oxo-1H-quinazolin-2-yl]sulfanyl]phenyl]acetamide Traditional Name: N-[4-[[4-amino-7-keto-5-(5-methyl-1H-pyrazol-3-yl)-1H-quinazolin-2-yl]thio]phenyl]acetamide Formula: C20H18N6O2S MolecularWeight: 406.46092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C2=CC(=O)C=C3C2=C(N=C(N3)SC4=CC=C(C=C4)NC(=O)C)N

Isomeric SMILES

CC1=CC(=NN1)C2=CC(=O)C=C3C2=C(N=C(N3)SC4=CC=C(C=C4)NC(=O)C)N

InChI

InChI=1S/C20H18N6O2S/c1-10-7-16(26-25-10)15-8-13(28)9-17-18(15)19(21)24-20(23-17)29-14-5-3-12(4-6-14)22-11(2)27/h3-9H,21H2,1-2H3,(H,22,27)(H,23,24)(H,25,26)