[1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)indol-3-yl] carbamimidothioate

Systemtic Name: [1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)indol-3-yl] carbamimidothioate Openeye Name: 2-[1-(2-morpholino-2-oxo-ethyl)indol-3-yl]isothiourea CAS Name: carbamimidothioic acid [1-[2-(4-morpholinyl)-2-oxoethyl]-3-indolyl] ester IUPAC Name: [1-(2-morpholin-4-yl-2-oxoethyl)indol-3-yl] carbamimidothioate Traditional Name: 2-[1-(2-keto-2-morpholino-ethyl)indol-3-yl]isothiourea Formula: C15H18N4O2S MolecularWeight: 318.39402

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CN2C=C(C3=CC=CC=C32)SC(=N)N

Isomeric SMILES

C1COCCN1C(=O)CN2C=C(C3=CC=CC=C32)SC(=N)N

InChI

InChI=1S/C15H18N4O2S/c16-15(17)22-13-9-19(12-4-2-1-3-11(12)13)10-14(20)18-5-7-21-8-6-18/h1-4,9H,5-8,10H2,(H3,16,17)