[7-[2-(aminomethyl)-1,3-thiazol-4-yl]-4-methoxy-1,3-benzothiazol-2-yl]carbamic acid

Systemtic Name: [7-[2-(aminomethyl)-1,3-thiazol-4-yl]-4-methoxy-1,3-benzothiazol-2-yl]carbamic acid Openeye Name: [7-[2-(aminomethyl)thiazol-4-yl]-4-methoxy-1,3-benzothiazol-2-yl]carbamic acid CAS Name: [7-[2-(aminomethyl)-4-thiazolyl]-4-methoxy-1,3-benzothiazol-2-yl]carbamic acid IUPAC Name: [7-[2-(aminomethyl)-1,3-thiazol-4-yl]-4-methoxy-1,3-benzothiazol-2-yl]carbamic acid Traditional Name: [7-[2-(aminomethyl)thiazol-4-yl]-4-methoxy-1,3-benzothiazol-2-yl]carbamic acid Formula: C13H12N4O3S2 MolecularWeight: 336.38938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3=CSC(=N3)CN)SC(=N2)NC(=O)O

Isomeric SMILES

COC1=C2C(=C(C=C1)C3=CSC(=N3)CN)SC(=N2)NC(=O)O

InChI

InChI=1S/C13H12N4O3S2/c1-20-8-3-2-6(7-5-21-9(4-14)15-7)11-10(8)16-12(22-11)17-13(18)19/h2-3,5H,4,14H2,1H3,(H,16,17)(H,18,19)