1-ethyl-3-[[2-methyl-1-[(4-nitrophenyl)methyl]indol-3-yl]methylideneamino]thiourea

Systemtic Name: 1-ethyl-3-[[2-methyl-1-[(4-nitrophenyl)methyl]indol-3-yl]methylideneamino]thiourea Openeye Name: 1-ethyl-3-[[2-methyl-1-[(4-nitrophenyl)methyl]indol-3-yl]methyleneamino]thiourea CAS Name: 1-ethyl-3-[[2-methyl-1-[(4-nitrophenyl)methyl]-3-indolyl]methylideneamino]thiourea IUPAC Name: 1-ethyl-3-[[2-methyl-1-[(4-nitrophenyl)methyl]indol-3-yl]methylideneamino]thiourea Traditional Name: 1-ethyl-3-[[2-methyl-1-(4-nitrobenzyl)indol-3-yl]methyleneamino]thiourea Formula: C20H21N5O2S MolecularWeight: 395.47804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=C(N(C2=CC=CC=C21)CC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCNC(=S)NN=CC1=C(N(C2=CC=CC=C21)CC3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H21N5O2S/c1-3-21-20(28)23-22-12-18-14(2)24(19-7-5-4-6-17(18)19)13-15-8-10-16(11-9-15)25(26)27/h4-12H,3,13H2,1-2H3,(H2,21,23,28)