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4-[(3-nitrophenyl)methylsulfanyl]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one

4-[(3-nitrophenyl)methylsulfanyl]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one

Systemtic Name:4-[(3-nitrophenyl)methylsulfanyl]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one
Openeye Name:4-[(3-nitrophenyl)methylsulfanyl]-1-(2-thienylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one
CAS Name:4-[(3-nitrophenyl)methylthio]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one
IUPAC Name:4-[(3-nitrophenyl)methylsulfanyl]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one
Traditional Name:4-[(3-nitrobenzyl)thio]-1-(2-thenyl)-5,6,7,8-tetrahydroquinazolin-2-one
Formula: C20H19N3O3S2
MolecularWeight: 413.51316
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NC(=O)N2CC3=CC=CS3)SCC4=CC(=CC=C4)[N+](=O)[O-]


Isomeric SMILES

C1CCC2=C(C1)C(=NC(=O)N2CC3=CC=CS3)SCC4=CC(=CC=C4)[N+](=O)[O-]


InChI

InChI=1S/C20H19N3O3S2/c24-20-21-19(28-13-14-5-3-6-15(11-14)23(25)26)17-8-1-2-9-18(17)22(20)12-16-7-4-10-27-16/h3-7,10-11H,1-2,8-9,12-13H2


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