3-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(4-nitrophenyl)propanamide

Systemtic Name: 3-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(4-nitrophenyl)propanamide Openeye Name: 3-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(4-nitrophenyl)propanamide CAS Name: 3-[[4-(ethylamino)-2-quinazolinyl]thio]-N-(4-nitrophenyl)propanamide IUPAC Name: 3-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(4-nitrophenyl)propanamide Traditional Name: 3-[[4-(ethylamino)quinazolin-2-yl]thio]-N-(4-nitrophenyl)propionamide Formula: C19H19N5O3S MolecularWeight: 397.45086

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SCCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SCCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O3S/c1-2-20-18-15-5-3-4-6-16(15)22-19(23-18)28-12-11-17(25)21-13-7-9-14(10-8-13)24(26)27/h3-10H,2,11-12H2,1H3,(H,21,25)(H,20,22,23)