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

Systemtic Name: 1-[[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methylideneamino]-3-ethyl-thiourea Openeye Name: 1-[[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methyleneamino]-3-ethyl-thiourea CAS Name: 1-[[2,5-dimethyl-1-(3-nitrophenyl)-3-pyrrolyl]methylideneamino]-3-ethylthiourea IUPAC Name: 1-[[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methylideneamino]-3-ethylthiourea Traditional Name: 1-[[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methyleneamino]-3-ethyl-thiourea Formula: C16H19N5O2S MolecularWeight: 345.41936

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=C(N(C(=C1)C)C2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CCNC(=S)NN=CC1=C(N(C(=C1)C)C2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H19N5O2S/c1-4-17-16(24)19-18-10-13-8-11(2)20(12(13)3)14-6-5-7-15(9-14)21(22)23/h5-10H,4H2,1-3H3,(H2,17,19,24)