N-(cyclopentylmethyl)-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(cyclopentylmethyl)-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-(cyclopentylmethyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(cyclopentylmethyl)-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(cyclopentylmethyl)-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-(cyclopentylmethyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3CCCC3)NC1=S

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3CCCC3)NC1=S

InChI

InChI=1S/C18H21N3O2S/c1-2-9-21-17(23)14-8-7-13(10-15(14)20-18(21)24)16(22)19-11-12-5-3-4-6-12/h2,7-8,10,12H,1,3-6,9,11H2,(H,19,22)(H,20,24)