1-[(E)-[2-chloranyl-3-[(E)-(methylcarbamothioylhydrazinylidene)methyl]-1-phenyl-indol-7-yl]methylideneamino]-3-methyl-thiourea

Systemtic Name: 1-[(E)-[2-chloranyl-3-[(E)-(methylcarbamothioylhydrazinylidene)methyl]-1-phenyl-indol-7-yl]methylideneamino]-3-methyl-thiourea Openeye Name: 1-[(E)-[2-chloro-3-[(E)-(methylcarbamothioylhydrazono)methyl]-1-phenyl-indol-7-yl]methyleneamino]-3-methyl-thiourea CAS Name: 1-[(E)-[2-chloro-3-[(E)-[[methylamino(sulfanylidene)methyl]hydrazinylidene]methyl]-1-phenyl-7-indolyl]methylideneamino]-3-methylthiourea IUPAC Name: 1-[(E)-[2-chloro-3-[(E)-(methylcarbamothioylhydrazinylidene)methyl]-1-phenylindol-7-yl]methylideneamino]-3-methylthiourea Traditional Name: 1-[(E)-[2-chloro-3-[(E)-(methylthiocarbamoylhydrazono)methyl]-1-phenyl-indol-7-yl]methyleneamino]-3-methyl-thiourea Formula: C20H20ClN7S2 MolecularWeight: 458.0027

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NN=CC1=CC=CC2=C1N(C(=C2C=NNC(=S)NC)Cl)C3=CC=CC=C3

Isomeric SMILES

CNC(=S)N/N=C/C1=CC=CC2=C1N(C(=C2/C=N/NC(=S)NC)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H20ClN7S2/c1-22-19(29)26-24-11-13-7-6-10-15-16(12-25-27-20(30)23-2)18(21)28(17(13)15)14-8-4-3-5-9-14/h3-12H,1-2H3,(H2,22,26,29)(H2,23,27,30)/b24-11+,25-12+