3-(furan-2-ylmethyl)-N-(3-methylbutyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(furan-2-ylmethyl)-N-(3-methylbutyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-(2-furylmethyl)-N-isopentyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(2-furanylmethyl)-N-(3-methylbutyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(furan-2-ylmethyl)-N-(3-methylbutyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-(2-furfuryl)-N-isoamyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C19H21N3O3S MolecularWeight: 371.45334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC3=CC=CO3

Isomeric SMILES

CC(C)CCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC3=CC=CO3

InChI

InChI=1S/C19H21N3O3S/c1-12(2)7-8-20-17(23)13-5-6-15-16(10-13)21-19(26)22(18(15)24)11-14-4-3-9-25-14/h3-6,9-10,12H,7-8,11H2,1-2H3,(H,20,23)(H,21,26)