4-[2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[2-(3-isopentyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[2-[[3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[2-[3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[2-[(3-isoamyl-4-keto-quinazolin-2-yl)thio]acetyl]-N-phenyl-piperazine-1-carboxamide Formula: C26H31N5O3S MolecularWeight: 493.62104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H31N5O3S/c1-19(2)12-13-31-24(33)21-10-6-7-11-22(21)28-26(31)35-18-23(32)29-14-16-30(17-15-29)25(34)27-20-8-4-3-5-9-20/h3-11,19H,12-18H2,1-2H3,(H,27,34)