1-cyclopropyl-3-(2-dimethylaminoethyl)-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea

Systemtic Name: 1-cyclopropyl-3-(2-dimethylaminoethyl)-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea Openeye Name: 1-cyclopropyl-3-(2-dimethylaminoethyl)-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea CAS Name: 1-cyclopropyl-3-(2-dimethylaminoethyl)-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea IUPAC Name: 1-cyclopropyl-3-(2-dimethylaminoethyl)-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea Traditional Name: 1-cyclopropyl-3-(2-dimethylaminoethyl)-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea Formula: C17H22N6O3S MolecularWeight: 390.45998

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=S)N(CC1=NN=C(O1)C2=CC(=CC=C2)[N+](=O)[O-])C3CC3

Isomeric SMILES

CN(C)CCNC(=S)N(CC1=NN=C(O1)C2=CC(=CC=C2)[N+](=O)[O-])C3CC3

InChI

InChI=1S/C17H22N6O3S/c1-21(2)9-8-18-17(27)22(13-6-7-13)11-15-19-20-16(26-15)12-4-3-5-14(10-12)23(24)25/h3-5,10,13H,6-9,11H2,1-2H3,(H,18,27)