1-[(5-chloranyl-1-benzothiophen-3-yl)methyl]-4-(phenylmethyl)-1,4-diazepane

Systemtic Name: 1-[(5-chloranyl-1-benzothiophen-3-yl)methyl]-4-(phenylmethyl)-1,4-diazepane Openeye Name: 1-benzyl-4-[(5-chlorobenzothiophen-3-yl)methyl]-1,4-diazepane CAS Name: 1-[(5-chloro-1-benzothiophen-3-yl)methyl]-4-(phenylmethyl)-1,4-diazepane IUPAC Name: 1-benzyl-4-[(5-chloro-1-benzothiophen-3-yl)methyl]-1,4-diazepane Traditional Name: 1-benzyl-4-[(5-chlorobenzothiophen-3-yl)methyl]-1,4-diazepane Formula: C21H23ClN2S MolecularWeight: 370.93872

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC2=CSC3=C2C=C(C=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)CC2=CSC3=C2C=C(C=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C21H23ClN2S/c22-19-7-8-21-20(13-19)18(16-25-21)15-24-10-4-9-23(11-12-24)14-17-5-2-1-3-6-17/h1-3,5-8,13,16H,4,9-12,14-15H2