(2-cyclohexyl-1,3-benzoxazol-6-yl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (2-cyclohexyl-1,3-benzoxazol-6-yl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (2-cyclohexyl-1,3-benzoxazol-6-yl)-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (2-cyclohexyl-1,3-benzoxazol-6-yl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (2-cyclohexyl-1,3-benzoxazol-6-yl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (2-cyclohexyl-1,3-benzoxazol-6-yl)-[4-(2-thenyl)-1,4-diazepan-1-yl]methanone Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC3=C(O2)C=C(C=C3)C(=O)N4CCCN(CC4)CC5=CC=CS5

Isomeric SMILES

C1CCC(CC1)C2=NC3=C(O2)C=C(C=C3)C(=O)N4CCCN(CC4)CC5=CC=CS5

InChI

InChI=1S/C24H29N3O2S/c28-24(27-12-5-11-26(13-14-27)17-20-8-4-15-30-20)19-9-10-21-22(16-19)29-23(25-21)18-6-2-1-3-7-18/h4,8-10,15-16,18H,1-3,5-7,11-14,17H2