[1-[2-[(2,4-dichlorophenyl)carbonylamino]ethyl]indol-3-yl] carbamimidothioate

Systemtic Name: [1-[2-[(2,4-dichlorophenyl)carbonylamino]ethyl]indol-3-yl] carbamimidothioate Openeye Name: N-[2-(3-carbamimidoylsulfanylindol-1-yl)ethyl]-2,4-dichloro-benzamide CAS Name: carbamimidothioic acid [1-[2-[[(2,4-dichlorophenyl)-oxomethyl]amino]ethyl]-3-indolyl] ester IUPAC Name: [1-[2-[(2,4-dichlorobenzoyl)amino]ethyl]indol-3-yl] carbamimidothioate Traditional Name: N-[2-[3-(amidinothio)indol-1-yl]ethyl]-2,4-dichloro-benzamide Formula: C18H16Cl2N4OS MolecularWeight: 407.31684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCNC(=O)C3=C(C=C(C=C3)Cl)Cl)SC(=N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCNC(=O)C3=C(C=C(C=C3)Cl)Cl)SC(=N)N

InChI

InChI=1S/C18H16Cl2N4OS/c19-11-5-6-12(14(20)9-11)17(25)23-7-8-24-10-16(26-18(21)22)13-3-1-2-4-15(13)24/h1-6,9-10H,7-8H2,(H3,21,22)(H,23,25)