ethyl 2-[bis(azanyl)methylideneamino]-6-phenyl-5,7-dihydro-4H-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[bis(azanyl)methylideneamino]-6-phenyl-5,7-dihydro-4H-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-guanidino-6-phenyl-5,7-dihydro-4H-1,3-benzothiazole-6-carboxylate CAS Name: 2-(diaminomethylideneamino)-6-phenyl-5,7-dihydro-4H-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(diaminomethylideneamino)-6-phenyl-5,7-dihydro-4H-1,3-benzothiazole-6-carboxylate Traditional Name: 2-guanidino-6-phenyl-5,7-dihydro-4H-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC2=C(C1)SC(=N2)N=C(N)N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCC2=C(C1)SC(=N2)N=C(N)N)C3=CC=CC=C3

InChI

InChI=1S/C17H20N4O2S/c1-2-23-14(22)17(11-6-4-3-5-7-11)9-8-12-13(10-17)24-16(20-12)21-15(18)19/h3-7H,2,8-10H2,1H3,(H4,18,19,20,21)