N-(2-tert-butylsulfinylethyl)-N'-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl]-N'-prop-2-ynyl-benzohydrazide

Systemtic Name: N-(2-tert-butylsulfinylethyl)-N'-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl]-N'-prop-2-ynyl-benzohydrazide Openeye Name: N-(2-tert-butylsulfinylethyl)-N'-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl]-N'-prop-2-ynyl-benzohydrazide CAS Name: N-(2-tert-butylsulfinylethyl)-N'-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl]-N'-prop-2-ynylbenzohydrazide IUPAC Name: N-(2-tert-butylsulfinylethyl)-N'-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl]-N'-prop-2-ynylbenzohydrazide Traditional Name: N-(2-tert-butylsulfinylethyl)-N'-[(4-keto-2-methyl-1H-quinazolin-6-yl)methyl]-N'-propargyl-benzohydrazide Formula: C26H30N4O3S MolecularWeight: 478.6064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=C(N1)C=CC(=C2)CN(CC#C)N(CCS(=O)C(C)(C)C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=O)C2=C(N1)C=CC(=C2)CN(CC#C)N(CCS(=O)C(C)(C)C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H30N4O3S/c1-6-14-29(18-20-12-13-23-22(17-20)24(31)28-19(2)27-23)30(15-16-34(33)26(3,4)5)25(32)21-10-8-7-9-11-21/h1,7-13,17H,14-16,18H2,2-5H3,(H,27,28,31)