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

Systemtic Name: 1-[(Z)-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)methylideneamino]-3-(2-nitrophenyl)thiourea Openeye Name: 1-[(Z)-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methyleneamino]-3-(2-nitrophenyl)thiourea CAS Name: 1-[(Z)-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)methylideneamino]-3-(2-nitrophenyl)thiourea IUPAC Name: 1-[(Z)-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)methylideneamino]-3-(2-nitrophenyl)thiourea Traditional Name: 1-[(Z)-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methyleneamino]-3-(2-nitrophenyl)thiourea Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C=NNC(=S)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)/C=N\NC(=S)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O2S/c1-11(2)21-12(3)9-14(13(21)4)10-18-20-17(25)19-15-7-5-6-8-16(15)22(23)24/h5-11H,1-4H3,(H2,19,20,25)/b18-10-