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

Systemtic Name: N-[2-[2-[2-(3-azanyl-5-methyl-pyrazol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethyl]ethanamide Openeye Name: N-[2-[2-[2-(3-amino-5-methyl-pyrazol-1-yl)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]ethyl]acetamide CAS Name: N-[2-[2-[[2-(3-amino-5-methyl-1-pyrazolyl)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]ethyl]acetamide IUPAC Name: N-[2-[2-[2-(3-amino-5-methylpyrazol-1-yl)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]ethyl]acetamide Traditional Name: N-[2-[2-[[2-(3-amino-5-methyl-pyrazol-1-yl)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]ethyl]acetamide Formula: C18H20N6O3S MolecularWeight: 400.4548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCNC(=O)C)N

Isomeric SMILES

CC1=CC(=NN1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCNC(=O)C)N

InChI

InChI=1S/C18H20N6O3S/c1-11-9-15(19)22-24(11)16(26)10-28-18-21-14-6-4-3-5-13(14)17(27)23(18)8-7-20-12(2)25/h3-6,9H,7-8,10H2,1-2H3,(H2,19,22)(H,20,25)