1-[(1,2-dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[(1,2-dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[(1,2-dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea CAS Name: 1-[(1,2-dimethyl-5-indolyl)methyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[(1,2-dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[(1,2-dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1C)C=CC(=C2)CNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(N1C)C=CC(=C2)CNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O2S/c1-12-9-14-10-13(3-8-17(14)21(12)2)11-19-18(25)20-15-4-6-16(7-5-15)22(23)24/h3-10H,11H2,1-2H3,(H2,19,20,25)