N-butyl-N-ethyl-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-butyl-N-ethyl-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-butyl-N-ethyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-butyl-N-ethyl-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-butyl-N-ethyl-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-butyl-N-ethyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC=C

Isomeric SMILES

CCCCN(CC)C(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC=C

InChI

InChI=1S/C18H23N3O2S/c1-4-7-11-20(6-3)16(22)13-8-9-14-15(12-13)19-18(24)21(10-5-2)17(14)23/h5,8-9,12H,2,4,6-7,10-11H2,1,3H3,(H,19,24)