N-(2-azanyl-1,3-benzothiazol-6-yl)ethanamide; 6-butoxy-1,3-benzothiazol-2-amine

Systemtic Name: N-(2-azanyl-1,3-benzothiazol-6-yl)ethanamide; 6-butoxy-1,3-benzothiazol-2-amine Openeye Name: N-(2-amino-1,3-benzothiazol-6-yl)acetamide; 6-butoxy-1,3-benzothiazol-2-amine CAS Name: N-(2-amino-1,3-benzothiazol-6-yl)acetamide; 6-butoxy-1,3-benzothiazol-2-amine IUPAC Name: N-(2-amino-1,3-benzothiazol-6-yl)acetamide; 6-butoxy-1,3-benzothiazol-2-amine Traditional Name: N-(2-amino-1,3-benzothiazol-6-yl)acetamide; (6-butoxy-1,3-benzothiazol-2-yl)amine Formula: C20H23N5O2S2 MolecularWeight: 429.55892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)N=C(S2)N.CC(=O)NC1=CC2=C(C=C1)N=C(S2)N

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)N=C(S2)N.CC(=O)NC1=CC2=C(C=C1)N=C(S2)N

InChI

InChI=1S/C11H14N2OS.C9H9N3OS/c1-2-3-6-14-8-4-5-9-10(7-8)15-11(12)13-9;1-5(13)11-6-2-3-7-8(4-6)14-9(10)12-7/h4-5,7H,2-3,6H2,1H3,(H2,12,13);2-4H,1H3,(H2,10,12)(H,11,13)