N-[cyclopentyl(thiophen-2-yl)methyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[cyclopentyl(thiophen-2-yl)methyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-[cyclopentyl(2-thienyl)methyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[cyclopentyl(thiophen-2-yl)methyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[cyclopentyl(thiophen-2-yl)methyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-[cyclopentyl(2-thienyl)methyl]-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC(C3CCCC3)C4=CC=CS4)NC1=S

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC(C3CCCC3)C4=CC=CS4)NC1=S

InChI

InChI=1S/C22H23N3O2S2/c1-2-11-25-21(27)16-10-9-15(13-17(16)23-22(25)28)20(26)24-19(14-6-3-4-7-14)18-8-5-12-29-18/h2,5,8-10,12-14,19H,1,3-4,6-7,11H2,(H,23,28)(H,24,26)