N-[2-[(4-nitrophenyl)amino]ethyl]-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[2-[(4-nitrophenyl)amino]ethyl]-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-[2-(4-nitroanilino)ethyl]-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-[2-(4-nitroanilino)ethyl]-2-(4-quinazolinylthio)acetamide IUPAC Name: N-[2-(4-nitroanilino)ethyl]-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-[2-(4-nitroanilino)ethyl]-2-(quinazolin-4-ylthio)acetamide Formula: C18H17N5O3S MolecularWeight: 383.42428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O3S/c24-17(11-27-18-15-3-1-2-4-16(15)21-12-22-18)20-10-9-19-13-5-7-14(8-6-13)23(25)26/h1-8,12,19H,9-11H2,(H,20,24)