8-[[4-(thiophen-3-ylmethyl)-1,4-diazepan-1-yl]carbonyl]naphthalene-1-carboxamide

Systemtic Name: 8-[[4-(thiophen-3-ylmethyl)-1,4-diazepan-1-yl]carbonyl]naphthalene-1-carboxamide Openeye Name: 8-[4-(3-thienylmethyl)-1,4-diazepane-1-carbonyl]naphthalene-1-carboxamide CAS Name: 8-[oxo-[4-(3-thiophenylmethyl)-1,4-diazepan-1-yl]methyl]-1-naphthalenecarboxamide IUPAC Name: 8-[4-(thiophen-3-ylmethyl)-1,4-diazepane-1-carbonyl]naphthalene-1-carboxamide Traditional Name: 8-[4-(3-thenyl)-1,4-diazepane-1-carbonyl]-1-naphthamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC=CC3=C2C(=CC=C3)C(=O)N)CC4=CSC=C4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC=CC3=C2C(=CC=C3)C(=O)N)CC4=CSC=C4

InChI

InChI=1S/C22H23N3O2S/c23-21(26)18-6-1-4-17-5-2-7-19(20(17)18)22(27)25-10-3-9-24(11-12-25)14-16-8-13-28-15-16/h1-2,4-8,13,15H,3,9-12,14H2,(H2,23,26)