1-[(4-chlorophenyl)methyl]-3-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)thiourea

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)thiourea Openeye Name: 1-[(4-chlorophenyl)methyl]-3-(4-morpholino-2,1,3-benzoxadiazol-7-yl)thiourea CAS Name: 1-[(4-chlorophenyl)methyl]-3-[4-(4-morpholinyl)-2,1,3-benzoxadiazol-7-yl]thiourea IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)thiourea Traditional Name: 1-(4-chlorobenzyl)-3-(7-morpholinobenzofurazan-4-yl)thiourea Formula: C18H18ClN5O2S MolecularWeight: 403.88582

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C3=NON=C23)NC(=S)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1COCCN1C2=CC=C(C3=NON=C23)NC(=S)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H18ClN5O2S/c19-13-3-1-12(2-4-13)11-20-18(27)21-14-5-6-15(17-16(14)22-26-23-17)24-7-9-25-10-8-24/h1-6H,7-11H2,(H2,20,21,27)