2-[2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoylamino]-N-cyclopentyl-benzamide

Systemtic Name: 2-[2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoylamino]-N-cyclopentyl-benzamide Openeye Name: 2-[[2-(3-allyl-7-chloro-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]-N-cyclopentyl-benzamide CAS Name: 2-[[2-[(7-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-1-oxoethyl]amino]-N-cyclopentylbenzamide IUPAC Name: 2-[[2-(7-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetyl]amino]-N-cyclopentylbenzamide Traditional Name: 2-[[2-[(3-allyl-7-chloro-4-keto-quinazolin-2-yl)thio]acetyl]amino]-N-cyclopentyl-benzamide Formula: C25H25ClN4O3S MolecularWeight: 497.009

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC=CC=C3C(=O)NC4CCCC4

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC=CC=C3C(=O)NC4CCCC4

InChI

InChI=1S/C25H25ClN4O3S/c1-2-13-30-24(33)19-12-11-16(26)14-21(19)29-25(30)34-15-22(31)28-20-10-6-5-9-18(20)23(32)27-17-7-3-4-8-17/h2,5-6,9-12,14,17H,1,3-4,7-8,13,15H2,(H,27,32)(H,28,31)