2-[bis(azanyl)methylideneamino]ethyl 4-(1H-indol-3-yl)-1,3-thiazole-2-carboxylate

Systemtic Name: 2-[bis(azanyl)methylideneamino]ethyl 4-(1H-indol-3-yl)-1,3-thiazole-2-carboxylate Openeye Name: 2-guanidinoethyl 4-(1H-indol-3-yl)thiazole-2-carboxylate CAS Name: 4-(1H-indol-3-yl)-2-thiazolecarboxylic acid 2-(diaminomethylideneamino)ethyl ester IUPAC Name: 2-(diaminomethylideneamino)ethyl 4-(1H-indol-3-yl)-1,3-thiazole-2-carboxylate Traditional Name: 4-(1H-indol-3-yl)thiazole-2-carboxylic acid 2-guanidinoethyl ester Formula: C15H15N5O2S MolecularWeight: 329.3769

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C3=CSC(=N3)C(=O)OCCN=C(N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C3=CSC(=N3)C(=O)OCCN=C(N)N

InChI

InChI=1S/C15H15N5O2S/c16-15(17)18-5-6-22-14(21)13-20-12(8-23-13)10-7-19-11-4-2-1-3-9(10)11/h1-4,7-8,19H,5-6H2,(H4,16,17,18)