(1Z)-1-[1-azanyl-4-(diethylamino)butylidene]-3-(2,4-dinitrophenyl)thiourea

Systemtic Name: (1Z)-1-[1-azanyl-4-(diethylamino)butylidene]-3-(2,4-dinitrophenyl)thiourea Openeye Name: (1Z)-1-[1-amino-4-(diethylamino)butylidene]-3-(2,4-dinitrophenyl)thiourea CAS Name: (1Z)-1-[1-amino-4-(diethylamino)butylidene]-3-(2,4-dinitrophenyl)thiourea IUPAC Name: (1Z)-1-[1-amino-4-(diethylamino)butylidene]-3-(2,4-dinitrophenyl)thiourea Traditional Name: (1Z)-1-[1-amino-4-(diethylamino)butylidene]-3-(2,4-dinitrophenyl)thiourea Formula: C15H22N6O4S MolecularWeight: 382.43798

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(=NC(=S)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])N

Isomeric SMILES

CCN(CC)CCC/C(=N/C(=S)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/N

InChI

InChI=1S/C15H22N6O4S/c1-3-19(4-2)9-5-6-14(16)18-15(26)17-12-8-7-11(20(22)23)10-13(12)21(24)25/h7-8,10H,3-6,9H2,1-2H3,(H3,16,17,18,26)