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N-(5-nitro-1,3-thiazol-2-yl)-4-oxidanylidene-1H-quinazoline-2-carbothioamide

N-(5-nitro-1,3-thiazol-2-yl)-4-oxidanylidene-1H-quinazoline-2-carbothioamide

Systemtic Name:N-(5-nitro-1,3-thiazol-2-yl)-4-oxidanylidene-1H-quinazoline-2-carbothioamide
Openeye Name:N-(5-nitrothiazol-2-yl)-4-oxo-1H-quinazoline-2-carbothioamide
CAS Name:N-(5-nitro-2-thiazolyl)-4-oxo-1H-quinazoline-2-carbothioamide
IUPAC Name:N-(5-nitro-1,3-thiazol-2-yl)-4-oxo-1H-quinazoline-2-carbothioamide
Traditional Name:4-keto-N-(5-nitrothiazol-2-yl)-1H-quinazoline-2-carbothioamide
Formula: C12H7N5O3S2
MolecularWeight: 333.34568
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=S)NC3=NC=C(S3)[N+](=O)[O-]


Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=S)NC3=NC=C(S3)[N+](=O)[O-]


InChI

InChI=1S/C12H7N5O3S2/c18-10-6-3-1-2-4-7(6)14-9(15-10)11(21)16-12-13-5-8(22-12)17(19)20/h1-5H,(H,13,16,21)(H,14,15,18)


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