4-[2-(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-N-methyl-benzamide

Systemtic Name: 4-[2-(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-N-methyl-benzamide Openeye Name: 4-[[2-(3-amino-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]-N-methyl-benzamide CAS Name: 4-[[2-[(3-amino-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]amino]-N-methylbenzamide IUPAC Name: 4-[[2-(3-amino-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]-N-methylbenzamide Traditional Name: 4-[[2-[(3-amino-4-keto-quinazolin-2-yl)thio]acetyl]amino]-N-methyl-benzamide Formula: C18H17N5O3S MolecularWeight: 383.42428

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2N

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2N

InChI

InChI=1S/C18H17N5O3S/c1-20-16(25)11-6-8-12(9-7-11)21-15(24)10-27-18-22-14-5-3-2-4-13(14)17(26)23(18)19/h2-9H,10,19H2,1H3,(H,20,25)(H,21,24)