1-[(5-chloranyl-2-ethoxy-phenyl)-(5-methylthiophen-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-chloranyl-2-ethoxy-phenyl)-(5-methylthiophen-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(5-chloro-2-ethoxy-phenyl)-(5-methyl-2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(5-chloro-2-ethoxyphenyl)-(5-methyl-2-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-chloro-2-ethoxyphenyl)-(5-methylthiophen-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(5-chloro-2-ethoxy-phenyl)-(5-methyl-2-thienyl)methyl]-1,4-diazepane Formula: C19H25ClN2OS MolecularWeight: 364.9326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C(C2=CC=C(S2)C)N3CCCNCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C(C2=CC=C(S2)C)N3CCCNCC3

InChI

InChI=1S/C19H25ClN2OS/c1-3-23-17-7-6-15(20)13-16(17)19(18-8-5-14(2)24-18)22-11-4-9-21-10-12-22/h5-8,13,19,21H,3-4,9-12H2,1-2H3