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

Systemtic Name: 1-cyclopropyl-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-prop-2-enyl-thiourea Openeye Name: 3-allyl-1-cyclopropyl-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea CAS Name: 1-cyclopropyl-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-prop-2-enylthiourea IUPAC Name: 1-cyclopropyl-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-prop-2-enylthiourea Traditional Name: 3-allyl-1-cyclopropyl-1-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]thiourea Formula: C16H17N5O3S MolecularWeight: 359.40288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N5O3S/c1-2-8-17-16(25)20(12-6-7-12)10-14-18-19-15(24-14)11-4-3-5-13(9-11)21(22)23/h2-5,9,12H,1,6-8,10H2,(H,17,25)