1-[(E)-[3-[(E)-(carbamothioylhydrazinylidene)methyl]-2-chloranyl-1-ethyl-indol-5-yl]methylideneamino]thiourea

Systemtic Name: 1-[(E)-[3-[(E)-(carbamothioylhydrazinylidene)methyl]-2-chloranyl-1-ethyl-indol-5-yl]methylideneamino]thiourea Openeye Name: [(E)-[3-[(E)-(carbamothioylhydrazono)methyl]-2-chloro-1-ethyl-indol-5-yl]methyleneamino]thiourea CAS Name: [(E)-[3-[(E)-(carbamothioylhydrazinylidene)methyl]-2-chloro-1-ethyl-5-indolyl]methylideneamino]thiourea IUPAC Name: [(E)-[3-[(E)-(carbamothioylhydrazinylidene)methyl]-2-chloro-1-ethylindol-5-yl]methylideneamino]thiourea Traditional Name: [(E)-[2-chloro-1-ethyl-3-[(E)-(thiocarbamoylhydrazono)methyl]indol-5-yl]methyleneamino]thiourea Formula: C14H16ClN7S2 MolecularWeight: 381.90674

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C=NNC(=S)N)C(=C1Cl)C=NNC(=S)N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)/C=N/NC(=S)N)C(=C1Cl)/C=N/NC(=S)N

InChI

InChI=1S/C14H16ClN7S2/c1-2-22-11-4-3-8(6-18-20-13(16)23)5-9(11)10(12(22)15)7-19-21-14(17)24/h3-7H,2H2,1H3,(H3,16,20,23)(H3,17,21,24)/b18-6+,19-7+