N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-[4-(2-amino-2-oxo-ethyl)thiazol-2-yl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[4-(2-amino-2-oxoethyl)-2-thiazolyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-[4-(2-amino-2-keto-ethyl)thiazol-2-yl]-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C17H15N5O3S2 MolecularWeight: 401.4627

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)CC(=O)N)NC1=S

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)CC(=O)N)NC1=S

InChI

InChI=1S/C17H15N5O3S2/c1-2-5-22-15(25)11-4-3-9(6-12(11)20-17(22)26)14(24)21-16-19-10(8-27-16)7-13(18)23/h2-4,6,8H,1,5,7H2,(H2,18,23)(H,20,26)(H,19,21,24)