ethyl 2-[2-[[4-(benzotriazol-1-ylmethyl)phenyl]carbonylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[[4-(benzotriazol-1-ylmethyl)phenyl]carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[[4-(benzotriazol-1-ylmethyl)benzoyl]amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[[4-(1-benzotriazolylmethyl)phenyl]-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[[4-(benzotriazol-1-ylmethyl)benzoyl]amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[4-(benzotriazol-1-ylmethyl)benzoyl]amino]thiazol-4-yl]acetic acid ethyl ester Formula: C21H19N5O3S MolecularWeight: 421.47226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H19N5O3S/c1-2-29-19(27)11-16-13-30-21(22-16)23-20(28)15-9-7-14(8-10-15)12-26-18-6-4-3-5-17(18)24-25-26/h3-10,13H,2,11-12H2,1H3,(H,22,23,28)