N-[1-(1-adamantyl)ethyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[1-(1-adamantyl)ethyl]-3-allyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[1-(1-adamantyl)ethyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[1-(1-adamantyl)ethyl]-3-allyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C24H29N3O2S MolecularWeight: 423.57096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC5=C(C=C4)C(=O)N(C(=S)N5)CC=C

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC5=C(C=C4)C(=O)N(C(=S)N5)CC=C

InChI

InChI=1S/C24H29N3O2S/c1-3-6-27-22(29)19-5-4-18(10-20(19)26-23(27)30)21(28)25-14(2)24-11-15-7-16(12-24)9-17(8-15)13-24/h3-5,10,14-17H,1,6-9,11-13H2,2H3,(H,25,28)(H,26,30)