1-[(Z)-[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methylideneamino]thiourea

Systemtic Name: 1-[(Z)-[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methylideneamino]thiourea Openeye Name: [(Z)-[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methyleneamino]thiourea CAS Name: [(Z)-[2,5-dimethyl-1-(3-nitrophenyl)-3-pyrrolyl]methylideneamino]thiourea IUPAC Name: [(Z)-[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methylideneamino]thiourea Traditional Name: [(Z)-[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methyleneamino]thiourea Formula: C14H15N5O2S MolecularWeight: 317.3662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)[N+](=O)[O-])C)C=NNC(=S)N

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)[N+](=O)[O-])C)/C=N\NC(=S)N

InChI

InChI=1S/C14H15N5O2S/c1-9-6-11(8-16-17-14(15)22)10(2)18(9)12-4-3-5-13(7-12)19(20)21/h3-8H,1-2H3,(H3,15,17,22)/b16-8-