2-[4-[(4-tert-butylphenyl)methyl]-1,4-diazepan-1-yl]-1,3-benzothiazole

Systemtic Name: 2-[4-[(4-tert-butylphenyl)methyl]-1,4-diazepan-1-yl]-1,3-benzothiazole Openeye Name: 2-[4-[(4-tert-butylphenyl)methyl]-1,4-diazepan-1-yl]-1,3-benzothiazole CAS Name: 2-[4-[(4-tert-butylphenyl)methyl]-1,4-diazepan-1-yl]-1,3-benzothiazole IUPAC Name: 2-[4-[(4-tert-butylphenyl)methyl]-1,4-diazepan-1-yl]-1,3-benzothiazole Traditional Name: 2-[4-(4-tert-butylbenzyl)-1,4-diazepan-1-yl]-1,3-benzothiazole Formula: C23H29N3S MolecularWeight: 379.56146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCCN(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCCN(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H29N3S/c1-23(2,3)19-11-9-18(10-12-19)17-25-13-6-14-26(16-15-25)22-24-20-7-4-5-8-21(20)27-22/h4-5,7-12H,6,13-17H2,1-3H3