1-[[2,5-dimethyl-1-(2-methyl-5-nitro-phenyl)pyrrol-3-yl]methylideneamino]thiourea

Systemtic Name: 1-[[2,5-dimethyl-1-(2-methyl-5-nitro-phenyl)pyrrol-3-yl]methylideneamino]thiourea Openeye Name: [[2,5-dimethyl-1-(2-methyl-5-nitro-phenyl)pyrrol-3-yl]methyleneamino]thiourea CAS Name: [[2,5-dimethyl-1-(2-methyl-5-nitrophenyl)-3-pyrrolyl]methylideneamino]thiourea IUPAC Name: [[2,5-dimethyl-1-(2-methyl-5-nitrophenyl)pyrrol-3-yl]methylideneamino]thiourea Traditional Name: [[2,5-dimethyl-1-(2-methyl-5-nitro-phenyl)pyrrol-3-yl]methyleneamino]thiourea Formula: C15H17N5O2S MolecularWeight: 331.39278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])N2C(=CC(=C2C)C=NNC(=S)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])N2C(=CC(=C2C)C=NNC(=S)N)C

InChI

InChI=1S/C15H17N5O2S/c1-9-4-5-13(20(21)22)7-14(9)19-10(2)6-12(11(19)3)8-17-18-15(16)23/h4-8H,1-3H3,(H3,16,18,23)