1-[(Z)-[4-(dimethylamino)-3-nitro-phenyl]methylideneamino]-3-propan-2-yl-thiourea

Systemtic Name: 1-[(Z)-[4-(dimethylamino)-3-nitro-phenyl]methylideneamino]-3-propan-2-yl-thiourea Openeye Name: 1-[(Z)-[4-(dimethylamino)-3-nitro-phenyl]methyleneamino]-3-isopropyl-thiourea CAS Name: 1-[(Z)-[4-(dimethylamino)-3-nitrophenyl]methylideneamino]-3-propan-2-ylthiourea IUPAC Name: 1-[(Z)-[4-(dimethylamino)-3-nitrophenyl]methylideneamino]-3-propan-2-ylthiourea Traditional Name: 1-[(Z)-[4-(dimethylamino)-3-nitro-benzylidene]amino]-3-isopropyl-thiourea Formula: C13H19N5O2S MolecularWeight: 309.38726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NN=CC1=CC(=C(C=C1)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=S)N/N=C\C1=CC(=C(C=C1)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H19N5O2S/c1-9(2)15-13(21)16-14-8-10-5-6-11(17(3)4)12(7-10)18(19)20/h5-9H,1-4H3,(H2,15,16,21)/b14-8-