N-[1-(cyclopropylmethyl)azepan-3-yl]-6-methoxy-1-methyl-benzotriazole-5-carboxamide

Systemtic Name: N-[1-(cyclopropylmethyl)azepan-3-yl]-6-methoxy-1-methyl-benzotriazole-5-carboxamide Openeye Name: N-[1-(cyclopropylmethyl)azepan-3-yl]-6-methoxy-1-methyl-benzotriazole-5-carboxamide CAS Name: N-[1-(cyclopropylmethyl)-3-azepanyl]-6-methoxy-1-methyl-5-benzotriazolecarboxamide IUPAC Name: N-[1-(cyclopropylmethyl)azepan-3-yl]-6-methoxy-1-methylbenzotriazole-5-carboxamide Traditional Name: N-[1-(cyclopropylmethyl)azepan-3-yl]-6-methoxy-1-methyl-benzotriazole-5-carboxamide Formula: C19H27N5O2 MolecularWeight: 357.44998

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C(=C2)OC)C(=O)NC3CCCCN(C3)CC4CC4)N=N1

Isomeric SMILES

CN1C2=C(C=C(C(=C2)OC)C(=O)NC3CCCCN(C3)CC4CC4)N=N1

InChI

InChI=1S/C19H27N5O2/c1-23-17-10-18(26-2)15(9-16(17)21-22-23)19(25)20-14-5-3-4-8-24(12-14)11-13-6-7-13/h9-10,13-14H,3-8,11-12H2,1-2H3,(H,20,25)